3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H13NO3
Molecular Weight	219.2365
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID

Structure Search

SMILES

COC1=CC=C2NC=C(CCC(O)=O)C2=C1

InChI

InChIKey=ZLSZCJIWILJKMR-UHFFFAOYSA-N

InChI=1S/C12H13NO3/c1-16-9-3-4-11-10(6-9)8(7-13-11)2-5-12(14)15/h3-4,6-7,13H,2,5H2,1H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C12H13NO3
Molecular Weight	219.2365
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:35:26 GMT 2023` Edited by `admin` on `Sat Dec 16 11:35:26 GMT 2023`
Record UNII	CS268A9K9W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID

Systematic Name

English

1H-INDOLE-3-PROPIONIC ACID, 5-METHOXY-

Systematic Name

English

5-METHOXY-3-INDOLEPROPIONIC ACID

Systematic Name

English

5-METHOXY-1H-INDOLE-3-PROPANOIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

CS268A9K9W

Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023

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DRUG BANK

DB07723

Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023

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EPA CompTox

DTXSID60960156

Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023

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PUBCHEM

181137

Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023

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CAS

39547-16-5

Created by admin on Sat Dec 16 11:35:26 GMT 2023 , Edited by admin on Sat Dec 16 11:35:26 GMT 2023

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