BCH - Moligand™, 10mM in Water , CAS No.20448-79-7

CAS: 20448-79-7 Cat. No.: B422486 Formule: C₈H₁₃NO₂ Poids moléculaire: 155.2

GRADE & PURITY Moligand™, 10mM in Water

Synonyms

DTXSID10942624 | NC00654 | J-013331 | Tertracid Ponceau 2R | BCHBCH | MFCD00167580 | Bicyclo(2.2.1)heptane-2-carboxylic acid, 2-amino- | GTPL4700 | 231A1554-11A8-45CA-9723-19013AAB1BEE | FT-0637999 | 2-Aminobicyclo[2.2.1]heptane-2-carboxylic acid # | b-BC

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonymes

DTXSID10942624 | NC00654 | J-013331 | Tertracid Ponceau 2R | BCHBCH | MFCD00167580 | Bicyclo(2.2.1)heptane-2-carboxylic acid, 2-amino- | GTPL4700 | 231A1554-11A8-45CA-9723-19013AAB1BEE | FT-0637999 | 2-Aminobicyclo[2.2.1]heptane-2-carboxylic acid # | b-BC

Spécifications et pureté

Moligand™, 10mM in Water

Mécanismes biochimiques et physiologiques

Inhibitor ofL-type amino acid transporter LAT1. Suppresses growth and induces apoptosis via activation of caspases in KB, Saos2 and C6 cancer cell lines.

Conditions de stockage de stockage

Store at -80°C

Expédié en

Dry ice packs + Cold packs

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Grade

Moligand™

Noms et identifiants

• Pubchem Sid: 528763400
• Sourires canoniques: C1CC2CC1CC2(C(=O)O)N
• IUPAC Name: 2-aminobicyclo[2.2.1]heptane-2-carboxylic acid
• InChIKey: MPUVBVXDFRDIPT-UHFFFAOYSA-N
• INCHI: 1S/C8H13NO2/c9-8(7(10)11)4-5-1-2-6(8)3-5/h5-6H,1-4,9H2,(H,10,11)
• Isomères SMILES: C1CC2CC1CC2(C(=O)O)N
• Poids moléculaire: 155.2
• Reaxy-Rn: 4131772
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4131772&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Bicyclic monoterpenoids
• Alternative Parents: Alpha amino acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Alpha-amino acid - Alpha-amino acid or derivatives - Bicyclic monoterpenoid - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Organopnictogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Aliphatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Cibles associées (humaines)

MCF7 (126967 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC7A5 Tchem L-type amino acid transporter 1 (388 Activities)

Discover Target: SLC7A5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC43A1 Tbio L-type amino acid transporter 3 (7 Activities)

Discover Target: SLC43A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Cibles associées (non humaines)

Slc16a10 Monocarboxylate transporter 10 (73 Activities)

Discover Target: Slc16a10

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Poids moléculaire: 155.190 g/mol
• XLogP3: -1.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 155.095 Da
• Monoisotopic Mass: 155.095 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 204.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 3
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Références

1. Longfa Kou, Xinyu Jiang, Yingying Tang, Xing Xia, Yingtao Li, Aimin Cai, Hailun Zheng, Hailin Zhang, Vadivel Ganapathy, Qing Yao, Ruijie Chen.  (2021)  Resetting amino acid metabolism of cancer cells by ATB0,+-targeted nanoparticles for enhanced anticancer therapy.  Bioactive Materials,      [PMID:34820552] [10.1016/j.bioactmat.2021.07.009]

2. Xueqian Yin, Pengfei Tan, Hao Luo, Jianwu Lan, Yidong Shi, Yong Zhang, Haojun Fan, Lin Tan.  (2019)  Study on the release behaviors of berberine hydrochloride based on sandwich nanostructure and shape memory effect.  Materials Science & Engineering C-Materials for Biological Applications,      [PMID:32228975] [10.1016/j.msec.2019.110541]

3. Xiao He, Zhongmin Wang, Huayang Bai, Yaqin Tang, Daimeng Feng, Shuyu Zhang, Robert J. Lee, Jing Xie, Yansun Sun.  (2025)  A dual-responsive metal-polyphenol nanomedicine based on targeting LAT1 via levodopa and ROS amplification for precise treatment of breast cancer.  FREE RADICAL BIOLOGY AND MEDICINE,      [PMID:41412529] [10.1016/j.freeradbiomed.2025.12.018]