ALPHA-CYANO-4-HYDROXYCINNAMIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H7NO3
Molecular Weight	189.1675
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ALPHA-CYANO-4-HYDROXYCINNAMIC ACID

Structure Search

SMILES

OC(=O)C(=CC1=CC=C(O)C=C1)C#N

InChI

InChIKey=AFVLVVWMAFSXCK-UHFFFAOYSA-N

InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)

HIDE SMILES / InChI

Molecular Formula	C10H7NO3
Molecular Weight	189.1675
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Targets

Targets

Primary Target	Pharmacology	Condition	Potency
p38 signaling pathway 1 Target ID: p38 signaling pathway Sources: https://www.ncbi.nlm.nih.gov/pubmed/29609037	Modulator 846
Monocarboxylate transporter 1 Target ID: Monocarboxylate transporter Sources: https://www.ncbi.nlm.nih.gov/pubmed/26765963 \| https://www.ncbi.nlm.nih.gov/pubmed/23955790	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:59:15 GMT 2025` Edited by `admin` on `Tue Apr 01 19:59:15 GMT 2025`
Record UNII	NL5EEM9E2G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-173138

Preferred Name

English

ALPHA-CYANO-4-HYDROXYCINNAMIC ACID

Systematic Name

English

2-CYANO-3-(4-HYDROXYPHENYL)ACRYLIC ACID

Systematic Name

English

ALPHA-CYANO-4-HYDROXYCINNAMATE

Systematic Name

English

Code System Code Type Description

CAS

28166-41-8

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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ECHA (EC/EINECS)

248-879-1

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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EPA CompTox

DTXSID501018295

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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WIKIPEDIA

alpha-Cyano-4-hydroxycinnamic acid

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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CHEBI

64340

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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FDA UNII

NL5EEM9E2G

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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NSC

173138

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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PUBCHEM

2102

Created by admin on Tue Apr 01 19:59:15 GMT 2025 , Edited by admin on Tue Apr 01 19:59:15 GMT 2025

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