3,5-Dihydroxybenzoic acid - Moligand™, 10mM in DMSO , Agonist of HCA 1 receptor, CAS No.99-10-5, Agonist of HCA 1 receptor

CAS: 99-10-5 Cat. No.: D427217 Peso molecular: 154.12 Beilstein Registry Number: 2207864 Número EC: 202-730-7
Disponible para pedir
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
Synonyms
AI3-52338 | BDBM50336490 | HY-W015560 | SCHEMBL28106 | 3,5-Dihydroxybenzoicacid | 34D | alpha-Resorcylic acid | GTPL5783 | FT-0602267 | 3,5-Dihydroxybenzoic acid, 97% | DTXSID8059184 | F0001-2331 | 3,5-Dihydroxybenzoic acid (ACD/Name 4.0) | P16552 | NSC 2
Storage
Protected from light,Store at -80°C
Shipped In
Dry ice packs + Cold packs
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Size
Estado
Price
Qty
1ml
D427217-1ml
1

58,90US$

69,90US$
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Why this grade

Moligand™, 10mM in DMSO Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Protected from light,Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 34 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
AI3-52338 | BDBM50336490 | HY-W015560 | SCHEMBL28106 | 3, 5-Dihydroxybenzoicacid | 34D | alpha-Resorcylic acid | GTPL5783 | FT-0602267 | 3, 5-Dihydroxybenzoic acid, 97% | DTXSID8059184 | F0001-2331 | 3, 5-Dihydroxybenzoic acid (ACD/Name 4.0) | P16552 | NSC 2
Especificaciones y pureza
Moligand™, 10mM in DMSO
Condiciones de almacenamiento de almacenamiento
Protected from light, Store at -80°C
Enviado en
Dry ice packs + Cold packs
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Tipo de acción
AGONIST
Mecanismo de acción
Agonist of HCA 1 receptor
Nombres e identificadores
Sonrisas canónicasC1=C(C=C(C=C1O)O)C(=O)O
IUPAC Name3,5-dihydroxybenzoic acid
InChIKeyUYEMGAFJOZZIFP-UHFFFAOYSA-N
INCHI1S/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11)
Isómeros SMILES C1=C(C=C(C=C1O)O)C(=O)O
WGK Alemania 1
RTECS VH3708000
Peso molecular 154.12
Beilstein 2207864
Reaxy-Rn 2207864
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207864&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentHydroxybenzoic acid derivatives
Alternative Parents Benzoic acids  Resorcinols  Benzoyl derivatives  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Monocarboxylic acids and derivatives  Carboxylic acids  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Hydroxybenzoic acid - Benzoic acid - Resorcinol - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. These are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups.
External Descriptors resorcinols - dihydroxybenzoic acid
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CA1 Tclin Carbonic anhydrase 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CA2 Tclin Carbonic anhydrase 2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CA14 Tclin Carbonic anhydrase 14 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HCAR1 Tchem Hydroxycarboxylic acid receptor 1 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CA2 Tclin Carbonic anhydrase II (17698 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA1 Tclin Carbonic anhydrase I (13240 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALB Tchem Serum albumin (2651 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA14 Tclin Carbonic anhydrase XIV (1305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA12 Tclin Carbonic anhydrase XII (6231 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA9 Tclin Carbonic anhydrase IX (8255 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TLR2 Tchem Toll-like receptor 2 (975 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCAR1 Tchem G-protein coupled receptor 81 (382 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Ca7 Carbonic anhydrase VII (3 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hcar2 Hydroxycarboxylic acid receptor 2 (55 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Carbonic anhydrase (69 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Saccharomyces cerevisiae (19171 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SensibilidadLight sensitive.
Punto de inflamación (°F)392 °F
Punto de inflamación (°C)≥200℃
Punto de fusión (°C)232-233°C
Peso molecular154.120 g/mol
XLogP30.900
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass154.027 Da
Monoisotopic Mass154.027 Da
Topological Polar Surface Area77.800 Ų
Heavy Atom Count11
Formal Charge0
Complexity147.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
1. Dali Fu, Haodong Wang, Tan Wang, Chunming Xu, Yehua Han.  (2023)  Structural insights into variation of intramolecular acid site using phase transition experiments and computation.  AICHE JOURNAL,  70  (4): (e18342).  [PMID:] [10.1002/aic.18342]
2. Diqin Zhang, Yu Zhao, Bin Guo, Zhen Zhang, Dejiao Hu, Zhen Wang, Jianhua Zhu, Yan Ye, Yuxia Zhao.  (2023)  Acrylate dendritic monomers for fabricating holographic data storage media with high performance.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2023.112436]
3. Hui Yang, Guoming Yuan, Enxiang Jiao, Kunxin Wang, WenJie Diao, Zhao Li, Kun Wu, Jun Shi.  (2023)  Low dielectric constant and high thermal stability of liquid crystal epoxy polymers based on functionalized poly(phenylene oxide).  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2023.112378]
4. Jian Yao, Lun Gui, Qizhang Long.  (2022)  A chlorogenic acid esterase from a metagenomic library with unique substrate specificity and its application in caffeic and ferulic acid production from agricultural byproducts.  BIOCATALYSIS AND BIOTRANSFORMATION,      [PMID:] [10.1080/10242422.2021.1969370]
5. Qiqin Wang, Lingjue Sun, Huihui Wu, Ning Deng, Xianglong Zhao, Jingwei Zhou, Tingting Zhang, Hai Han, Zhengjin Jiang.  (2022)  Rapid fabrication of zwitterionic sulfobetaine vinylimidazole-based monoliths via photoinitiated copolymerization for hydrophilic interaction chromatography.  Journal of Pharmaceutical Analysis,      [PMID:36320596] [10.1016/j.jpha.2022.05.008]
6. Guojia Yu, Xinjian Chen, Lichao He, Xiangrong Li, Zhiyong Zhou, Zhongqi Ren.  (2021)  Study on the solubilization of telmisartan by forming cocrystals with aromatic carboxylic acids.  CRYSTENGCOMM,  23  (27): (4871-4878).  [PMID:] [10.1039/D1CE00551K]
7. Lu Wang, Ke Jing, Baowei Hu, Junhe Lu.  (2021)  Hydrogen peroxide suppresses the formation of brominated oxidation by-products in heat-activated peroxydisulfate oxidation process.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.129138]
8. Shiyun Tang, Yuanxing Duan, Feng Chang, Wei Jiang, Fengmei Zhang, Zhihua Liu, Yuting Yang, Chunbo Liu, Yingzhuang Chen.  (2020)  The fabrication of carboxylic acid-functionalized porous layer open tube column and its application in hydrophilic interaction chromatography for small polar molecules.  JOURNAL OF LIQUID CHROMATOGRAPHY & RELATED TECHNOLOGIES,      [PMID:] [10.1080/10826076.2020.1848864]
9. Bingya Chen, Chenyang Zhang, Yanmei Zhao, Dongsheng Wang, Gregory V. Korshin, Jinren Ni, Mingquan Yan.  (2020)  Interpreting main features of the differential absorbance spectra of chlorinated natural organic matter: Comparison of the experimental and theoretical spectra of model compounds.  WATER RESEARCH,      [PMID:32736281] [10.1016/j.watres.2020.116206]
10. Ma Mingxuan, Du Yingxiang, Zhang Liu, Gan Jie, Yang Jiangxia.  (2020)  β-Cyclodextrin covalent organic framework–modified organic polymer monolith as a stationary phase for combined hydrophilic and hydrophobic aqueous capillary electrochromatographic separation of small molecules.  MICROCHIMICA ACTA,  187  (7): (1-11).  [PMID:32533434] [10.1007/s00604-020-04360-1]
11. Ke Jing, Deyang Kong, Junhe Lu.  (2020)  Change of disinfection byproducts formation potential of natural organic matter after exposure to persulphate and bicarbonate.  WATER RESEARCH,      [PMID:32679387] [10.1016/j.watres.2020.115970]
12. Qiqin Wang, Kun Peng, Ning Gan, Xiao Liu, Hao Huang, Huikai Shao, Hanying Jin, Jacques Crommen, Zhengjin Jiang.  (2020)  Rapid fabrication of versatile zwitterionic super-hydrophilic polymers by sole-monomer system for biomolecules separation.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2020.125121]
13. Qiqin Wang, Qiaoxuan Zhang, Hao Huang, Pengwei Zhao, Lingjue Sun, Kun Peng, Xiao Liu, Meng Ruan, Huikai Shao, Jacques Crommen, Pei Yu, Zhengjin Jiang.  (2019)  Fabrication and application of zwitterionic phosphorylcholine functionalized monoliths with different hydrophilic crosslinkers in hydrophilic interaction chromatography.  ANALYTICA CHIMICA ACTA,      [PMID:32029114] [10.1016/j.aca.2019.12.016]
14. Qian Tao, Qian-Qian Hao, Alexander P. Voronin, Xia-Lin Dai, Yu Huang, German L. Perlovich, Tong-Bu Lu, Jia-Mei Chen.  (2019)  Polymorphic Forms of a Molecular Salt of Phenazopyridine with 3,5-Dihydroxybenzoic Acid: Crystal Structures, Theoretical Calculations, Thermodynamic Stability, and Solubility Aspects.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.9b00618]
15. Wang Lu, Ji Yuefei, Lu Junhe, Kong Deyang, Yin Xiaoming, Zhou Quansuo.  (2017)  Comparative study of the formation of brominated disinfection byproducts in UV/persulfate and UV/H2O2 oxidation processes in the presence of bromide.  ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH,  24  (29): (23219-23225).  [PMID:28831656] [10.1007/s11356-017-9935-z]
16. Rongbin Huang, Lei Xiang, Ying Liu, Xiangping Deng, Xuan Cao, Lanfang Li, Cuiyun Yu, Yanming Chen, Guotao Tang.  (2016)  Synthesis and in vitro evaluation of pH-sensitive PEG-I-dC16 block polymer micelles for anticancer drug delivery.  JOURNAL OF PHARMACY AND PHARMACOLOGY,  68  (6): (751-761).  [PMID:27018539] [10.1111/jphp.12545]
17. Xiaoming Zhang, Fuxing Sun, Tingting Zhang, Jiangtao Jia, Hongmin Su, Chenhui Wang, Guangshan Zhu.  (2015)  Three pharmaceuticals cocrystals of adefovir: Syntheses, structures and dissolution study.  JOURNAL OF MOLECULAR STRUCTURE,      [PMID:] [10.1016/j.molstruc.2015.07.033]
18. Jia-Mei Chen, Song Li, Tong-Bu Lu.  (2014)  Pharmaceutical Cocrystals of Ribavirin with Reduced Release Rates.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/cg501247x]
19. Jia-Xi Song, Yan Yan, Jia Yao, Jia-Mei Chen, Tong-Bu Lu.  (2014)  Improving the Solubility of Lenalidomide via Cocrystals.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/cg500327s]
20. Guangxin Yuan, Yongbo Peng, Zhenghua Liu, Jieya Hong, Yao Xiao, Jialiang Guo, Norman W. Smith, Jacques Crommen, Zhengjin Jiang.  (2013)  A facile and efficient strategy to enhance hydrophilicity of zwitterionic sulfoalkylbetaine type monoliths.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:23796416] [10.1016/j.chroma.2013.05.063]
21. Zhenghua Liu, Yongbo Peng, Tingting Wang, Guangxin Yuan, Qiaoxuan Zhang, Jialiang Guo, Zhengjin Jiang.  (2012)  Preparation and application of novel zwitterionic monolithic column for hydrophilic interaction chromatography.  JOURNAL OF SEPARATION SCIENCE,  36  (2): (262-269).  [PMID:23180752] [10.1002/jssc.201200682]
22. Yanan Mao, Kairu Wang, Mengge Liu, Chenyue Lu, Xinghua Zhao, Xin He.  (2024)  Enhancing the Bioavailability of a Novel Enrofloxacin Salt by Inhibiting Precipitation via a Crystallization Inhibitor.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.4c00021]
23. Shangguang Du, Hao Wan, Jun Luo, Xiaohua Duan, Zhengrong Zou.  (2024)  Metabolic profiling of Citrus maxima L. seedlings in response to cadmium stress using UPLC-QTOF-MS.  PLANT PHYSIOLOGY AND BIOCHEMISTRY,      [PMID:38996714] [10.1016/j.plaphy.2024.108920]
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25. Jianhong Liu, Yujie Han, Xin He, Xinghua Zhao.  (2025)  Piperine cocrystals ameliorates type 2 diabetes by regulating glycolipid metabolism and reshaping gut microbiota in mice.  JOURNAL OF DRUG DELIVERY SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.jddst.2025.107356]
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30. Liang Lai, Hongying Lan, Hui Huang, Tong Li, Kesara Ar-sanork, Jia-Huan Qu, Dongsheng Xu, Zhengjin Jiang.  (2025)  Fabrication and evaluation of a dual-zwitterionic functionalized hydrophilic monolith for chromatographic separation.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:40199033] [10.1016/j.chroma.2025.465917]
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32. Qingguang Bao, Wenzhi Li, Ning Wang, Shan Cheng, Jiangang Liu, Bing Wang, Jingyao Feng, Qingfeng Sun, Nan Li, Xigao Jian.  (2025)  A novel water-soluble sizing agent that enhances the interface and tribological characteristics of CF/PPEK composites.  COMPOSITES PART B-ENGINEERING,      [PMID:] [10.1016/j.compositesb.2025.112170]
33. Minyi Yuan, Zheng Zhao, Ji Wu, Sumin Bian, Yuling Liao, Ying Zhou, Huikai Shao, Zhengjin Jiang, Qiqin Wang.  (2025)  Zwitterionic Imidazolium Sulfonate Functionalized Polymeric Monolith for Mixed-Mode HILIC/RPLC Applications.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:41106254] [10.1016/j.chroma.2025.466462]
34. Chao Li, Yan Song, Dongxiang Chen, Guo Liang Li.  (2025)  Room-Temperature Self-Healing Composites with Excellent Strength and Toughness for Anticorrosion Applications.  ACS Applied Materials & Interfaces,      [PMID:41418834] [10.1021/acsami.5c20436]
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