U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7NO2
Molecular Weight 137.136
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Amino-2-hydroxy-2,4,6-cycloheptatrien-1-one

SMILES

NC1=CC=C(O)C(=O)C=C1

InChI

InChIKey=SJJUTRFFONLOHZ-UHFFFAOYSA-N
InChI=1S/C7H7NO2/c8-5-1-3-6(9)7(10)4-2-5/h1-4H,8H2,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H7NO2
Molecular Weight 137.136
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 Tue Apr 01 19:35:49 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:49 GMT 2025
Record UNII
FM98CTZ6ZR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-102877
Preferred Name English
5-Amino-2-hydroxy-2,4,6-cycloheptatrien-1-one
Systematic Name English
2,4,6-Cycloheptatrien-1-one, 5-amino-2-hydroxy-
Systematic Name English
Code System Code Type Description
PUBCHEM
23450
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
NSC
102877
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
CAS
7021-46-7
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
FDA UNII
FM98CTZ6ZR
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY
EPA CompTox
DTXSID90990446
Created by admin on Tue Apr 01 19:35:49 GMT 2025 , Edited by admin on Tue Apr 01 19:35:49 GMT 2025
PRIMARY