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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H7NO4
Molecular Weight 193.1562
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D-DOPACHROME

SMILES

OC(=O)[C@H]1CC2=CC(=O)C(=O)C=C2N1

InChI

InChIKey=VJNCICVKUHKIIV-ZCFIWIBFSA-N
InChI=1S/C9H7NO4/c11-7-2-4-1-6(9(13)14)10-5(4)3-8(7)12/h2-3,6,10H,1H2,(H,13,14)/t6-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H7NO4
Molecular Weight 193.1562
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:30:41 GMT 2023
Edited
by admin
on Sat Dec 16 15:30:41 GMT 2023
Record UNII
29V7SPU29Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
D-DOPACHROME
Common Name English
(2R)-2,3,5,6-TETRAHYDRO-5,6-DIOXO-1H-INDOLE-2-CARBOXYLIC ACID
Systematic Name English
1H-INDOLE-2-CARBOXYLIC ACID, 2,3,5,6-TETRAHYDRO-5,6-DIOXO-, (2R)-
Systematic Name English
(2R)-5,6-DIOXO-2,3,5,6-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID701180993
Created by admin on Sat Dec 16 15:30:41 GMT 2023 , Edited by admin on Sat Dec 16 15:30:41 GMT 2023
PRIMARY
CAS
203000-17-3
Created by admin on Sat Dec 16 15:30:41 GMT 2023 , Edited by admin on Sat Dec 16 15:30:41 GMT 2023
PRIMARY
FDA UNII
29V7SPU29Z
Created by admin on Sat Dec 16 15:30:41 GMT 2023 , Edited by admin on Sat Dec 16 15:30:41 GMT 2023
PRIMARY
PUBCHEM
24771780
Created by admin on Sat Dec 16 15:30:41 GMT 2023 , Edited by admin on Sat Dec 16 15:30:41 GMT 2023
PRIMARY
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