3,5-Dihydroxy-2-naphthoic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H8O4
Molecular Weight	204.1788
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-Dihydroxy-2-naphthoic acid

Structure Search

SMILES

OC(=O)C1=CC2=CC=CC(O)=C2C=C1O

InChI

InChIKey=YELLAPKUWRTITI-UHFFFAOYSA-N

InChI=1S/C11H8O4/c12-9-3-1-2-6-4-8(11(14)15)10(13)5-7(6)9/h1-5,12-13H,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C11H8O4
Molecular Weight	204.1788
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Potency
Ionotropic glutamate receptor NMDA 1/2D 2 Target ID: CHEMBL3038505 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20858708	Positive Allosteric Modulator 179
Glutamate [NMDA] receptor subunit epsilon 1 2 Target ID: CHEMBL1972 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20858708	Negative Allosteric Modulator 42	9.7 µM [IC50]
Glutamate [NMDA] receptor subunit epsilon 2 13 Target ID: CHEMBL1904 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20858708	Negative Allosteric Modulator 42	9.4 µM [IC50]
Glutamate [NMDA] receptor subunit epsilon 3 1 Target ID: CHEMBL4109 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20858708	Negative Allosteric Modulator 42	15.0 µM [IC50]

PubMed

Title	Date	PubMed
A novel family of negative and positive allosteric modulators of NMDA receptors.	2010 Dec	20858708
Pharmacological modulation of NMDA receptor activity and the advent of negative and positive allosteric modulators.	2012 Sep	22269804

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:04:06 GMT 2023` Edited by `admin` on `Sat Dec 16 12:04:06 GMT 2023`
Record UNII	RCB7DWP5NB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,5-Dihydroxy-2-naphthoic acid

Systematic Name

English

3,5-Dihydroxy-2-carboxynaphthalene

Systematic Name

English

3,5-Dihydroxy-2-naphthalenecarboxylic acid

Systematic Name

English

2,8-Dihydroxy-3-naphthoic acid

Systematic Name

English

2-Naphthoic acid, 3,5-dihydroxy-

Systematic Name

English

1,7-Dihydroxy-6-naphthoic acid

Systematic Name

English

2,8-Dihydroxynaphthalene-3-carboxylic acid

Systematic Name

English

1,7-Dihydroxy-6-naphthalenecarboxylic acid

Systematic Name

English

2-Naphthalenecarboxylic acid, 3,5-dihydroxy-

Systematic Name

English

NSC-50694

Code

English

Code System Code Type Description

FDA UNII

RCB7DWP5NB