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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14N2O3
Molecular Weight 234.2512
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-Aminoethyl)-5-methoxy-1H-indole-2-carboxylic acid

SMILES

COC1=CC2=C(NC(C(O)=O)=C2CCN)C=C1

InChI

InChIKey=FBEQOUNJJYSFJU-UHFFFAOYSA-N
InChI=1S/C12H14N2O3/c1-17-7-2-3-10-9(6-7)8(4-5-13)11(14-10)12(15)16/h2-3,6,14H,4-5,13H2,1H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C12H14N2O3
Molecular Weight 234.2512
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 Wed Apr 02 19:35:10 GMT 2025
Edited
by admin
on Wed Apr 02 19:35:10 GMT 2025
Record UNII
P633T972KW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-Aminoethyl)-5-methoxy-1H-indole-2-carboxylic acid
Systematic Name English
2-Carboxy-5-methoxytryptamine
Preferred Name English
5-Methoxytryptamine-2-carboxylic acid
Common Name English
1H-Indole-2-carboxylic acid, 3-(2-aminoethyl)-5-methoxy-
Systematic Name English
Code System Code Type Description
PUBCHEM
698111
Created by admin on Wed Apr 02 19:35:10 GMT 2025 , Edited by admin on Wed Apr 02 19:35:10 GMT 2025
PRIMARY
FDA UNII
P633T972KW
Created by admin on Wed Apr 02 19:35:10 GMT 2025 , Edited by admin on Wed Apr 02 19:35:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID80967081
Created by admin on Wed Apr 02 19:35:10 GMT 2025 , Edited by admin on Wed Apr 02 19:35:10 GMT 2025
PRIMARY
CAS
52648-13-2
Created by admin on Wed Apr 02 19:35:10 GMT 2025 , Edited by admin on Wed Apr 02 19:35:10 GMT 2025
PRIMARY
Related Record Type Details
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