Chlorogenic acid - Moligand™, ≥95% , Inhibitor of protein tyrosine phosphatase non-receptor type 1, CAS No.327-97-9, Inhibitor of protein tyrosine phosphatase non-receptor type 1

Name: Chlorogenic acid - Moligand™, ≥95% , Inhibitor of protein tyrosine phosphatase non-receptor type 1, CAS No.327-97-9, Inhibitor of protein tyrosine phosphatase non-receptor type 1
SKU: C109402
Availability: InStock

CAS: 327-97-9 Cat. No.: C109402 Formule: C₁₆H₁₈O₉ Poids moléculaire: 354.31 Numéro CE: 206-325-6 PubChem CID: 1794427

279 Citations COA

Skip to the end of the images gallery

Chlorogenic acid - Moligand™, ≥95% CAS No(327-97-9) C109402 by Aladdin Scientific

Skip to the beginning of the images gallery

DISPONIBLE À COMMANDE

GRADE & PURITY Moligand™ ? ≥95%

Synonyms

(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylicacid | 3-(3,4-Dihydroxycinnamoyl)quinate | 3-trans-Caffeoylquinic acid | BDBM50327036 | Cyclohexanecarboxylic acid, 3-(((2E)-3-(3,4-dihydroxyphenyl)-1-oxo

Storage

Room temperature

Shipped In

Normal

Specifications Noms et identifiants Documentation Advanced Data Taxonomic Classification Structure 3D Cibles associées (humaines) Cibles associées (non humaines) Mécanismes d'action Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques FAQ et articles Citations of This Product Calculateurs de solution Avis

🧪

Why this grade

Moligand™, ≥95% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

Cited in 279 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonymes

Spécifications et pureté

Moligand™, ≥95%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Grade

Moligand™

Type d'action

INHIBITOR

Mécanisme d'action

Inhibitor of protein tyrosine phosphatase non-receptor type 1

Pureté

≥95%

Noms et identifiants

Pubchem Sid

508815910

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508815910

Sourires canoniques

O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O

IUPAC Name

(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid

InChIKey

CWVRJTMFETXNAD-JUHZACGLSA-N

INCHI

1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1

Isomères SMILES

C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O

WGK Allemagne

PubChem CID

1794427

Poids moléculaire

354.31

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

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Classe Organooxygen compounds
    - Subclass Alcohols and polyols
      - Level5 Cyclic alcohols and derivatives
        Level6 Cyclitols and derivatives
        Level7 Quinic acids and derivatives

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Classe	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Cyclic alcohols and derivatives - Cyclitols and derivatives
Direct Parent	Quinic acids and derivatives
Alternative Parents	Coumaric acids and derivatives Cinnamic acid esters Styrenes Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Fatty acid esters Cyclohexanols Alpha hydroxy acids and derivatives Dicarboxylic acids and derivatives Tertiary alcohols Enoate esters Polyols Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Quinic acid - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Catechol - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexanol - Fatty acid ester - Phenol - Fatty acyl - Hydroxy acid - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Alpha-hydroxy acid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tertiary alcohol - Secondary alcohol - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Polyol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as quinic acids and derivatives. These are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3.4, and 5, as well as a carboxylic acid at position 1.
External Descriptors	Caffeate derivatives
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

Structure 3D

Cibles associées (humaines)

PTPN1 Tchem Tyrosine-protein phosphatase non-receptor type 1 (1 Activities)

Discover Target: PTPN1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AKR1B1 Tclin Aldose reductase (1 Activities)

Discover Target: AKR1B1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

F2 Tclin Thrombin (11687 Activities)

Discover Target: F2

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

TYR Tclin Tyrosinase (717 Activities)

Discover Target: TYR

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

ACHE Tclin Acetylcholinesterase (18204 Activities)

Discover Target: ACHE

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

PTGS2 Tclin Cyclooxygenase-2 (13999 Activities)

Discover Target: PTGS2

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

AKR1B1 Tclin Aldose reductase (1404 Activities)

Discover Target: AKR1B1

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

PLA2G7 Tchem LDL-associated phospholipase A2 (1338 Activities)

Discover Target: PLA2G7

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

LCK Tclin Tyrosine-protein kinase LCK (9212 Activities)

Discover Target: LCK

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

PTPN2 Tchem T-cell protein-tyrosine phosphatase (1317 Activities)

Discover Target: PTPN2

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

SRC Tclin Tyrosine-protein kinase SRC (10310 Activities)

Discover Target: SRC

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

APP Tclin Amyloid-beta A4 protein (8510 Activities)

Discover Target: APP

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

AMY2A Tclin Pancreatic alpha-amylase (74 Activities)

Discover Target: AMY2A

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

DUSP3 Tchem Dual specificity protein phosphatase 3 (1161 Activities)

Discover Target: DUSP3

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

STAT3 Tchem Signal transducer and activator of transcription 3 (3313 Activities)

Discover Target: STAT3

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

PTPN6 Tchem Protein-tyrosine phosphatase 1C (687 Activities)

Discover Target: PTPN6

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

PTPN11 Tchem Protein-tyrosine phosphatase 2C (2297 Activities)

Discover Target: PTPN11

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

MCF7 (126967 Activities)

Lot Number	Certificate Type	Date	Article
I2608447	Certificate of Analysis	Sep 11, 2026	C109402
I2608450	Certificate of Analysis	Sep 11, 2026	C109402
I2608440	Certificate of Analysis	Sep 10, 2026	C109402
I2608442	Certificate of Analysis	Sep 10, 2026	C109402
I2608443	Certificate of Analysis	Sep 10, 2026	C109402
I2608448	Certificate of Analysis	Sep 10, 2026	C109402
L2502255	Certificate of Analysis	Jun 26, 2026	C109402
F2617032	Certificate of Analysis	Jun 26, 2026	C109402
D2609198	Certificate of Analysis	Apr 20, 2026	C109402
E2413220	Certificate of Analysis	Feb 05, 2026	C109402
L2510635	Certificate of Analysis	Dec 12, 2025	C109402
J2523442	Certificate of Analysis	Nov 04, 2025	C109402
J2523452	Certificate of Analysis	Oct 31, 2025	C109402
J2523476	Certificate of Analysis	Oct 31, 2025	C109402
J2523477	Certificate of Analysis	Oct 31, 2025	C109402
J2523478	Certificate of Analysis	Oct 31, 2025	C109402
F2520482	Certificate of Analysis	Oct 23, 2025	C109402
F2520489	Certificate of Analysis	Jul 02, 2025	C109402
F2520483	Certificate of Analysis	Jul 02, 2025	C109402
H2325289	Certificate of Analysis	Jun 10, 2025	C109402
H2325318	Certificate of Analysis	Jun 10, 2025	C109402
H2325322	Certificate of Analysis	Jun 10, 2025	C109402
H2325320	Certificate of Analysis	Jun 10, 2025	C109402
H2325321	Certificate of Analysis	Jun 10, 2025	C109402
B2511345	Certificate of Analysis	Feb 14, 2025	C109402
B2511344	Certificate of Analysis	Feb 14, 2025	C109402
B2511346	Certificate of Analysis	Feb 14, 2025	C109402
B2511347	Certificate of Analysis	Feb 14, 2025	C109402
K2401306	Certificate of Analysis	Nov 08, 2024	C109402
K2401300	Certificate of Analysis	Nov 08, 2024	C109402
K2401295	Certificate of Analysis	Nov 08, 2024	C109402
K2401291	Certificate of Analysis	Nov 08, 2024	C109402
K2401288	Certificate of Analysis	Nov 08, 2024	C109402
L2210438	Certificate of Analysis	Sep 18, 2024	C109402
H2413419	Certificate of Analysis	Aug 21, 2024	C109402
H2413420	Certificate of Analysis	Aug 21, 2024	C109402
H2413421	Certificate of Analysis	Aug 21, 2024	C109402
H2413422	Certificate of Analysis	Aug 21, 2024	C109402
E2413223	Certificate of Analysis	May 17, 2024	C109402
G2401045	Certificate of Analysis	May 17, 2024	C109402
E2413224	Certificate of Analysis	May 17, 2024	C109402
E2413199	Certificate of Analysis	May 17, 2024	C109402
J2330311	Certificate of Analysis	Nov 02, 2023	C109402
J2330330	Certificate of Analysis	Nov 02, 2023	C109402
J2330331	Certificate of Analysis	Nov 02, 2023	C109402
J2330332	Certificate of Analysis	Nov 02, 2023	C109402
H2325319	Certificate of Analysis	Aug 31, 2023	C109402
H2325287	Certificate of Analysis	Aug 31, 2023	C109402
H2325288	Certificate of Analysis	Aug 31, 2023	C109402
H2325317	Certificate of Analysis	Aug 31, 2023	C109402
G2308176	Certificate of Analysis	Jul 13, 2023	C109402
L2210436	Certificate of Analysis	Dec 16, 2022	C109402
G2220471	Certificate of Analysis	Jan 12, 2022	C109402
G2220470	Certificate of Analysis	Jan 12, 2022	C109402
J2113510	Certificate of Analysis	Oct 18, 2021	C109402

Solubilité	Soluble in water; Very soluble in Acetone,Alcohol
Rotation spécifique [α]	-37 ° (C=1, H2O)
Point de fusion (°C)	210°C
Poids moléculaire	354.310 g/mol
XLogP3	-0.400
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Exact Mass	354.095 Da
Monoisotopic Mass	354.095 Da
Topological Polar Surface Area	165.000 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	534.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

Chlorogenic acid - Moligand™, ≥95% , Inhibitor of protein tyrosine phosphatase non-receptor type 1, CAS No.327-97-9, Inhibitor of protein tyrosine phosphatase non-receptor type 1

Storage & shipping

Quality documents

Literature proof

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

Avis des clients

📚 Citations by Application

Need help choosing the grade?

View related series