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

Details

Stereochemistry ABSOLUTE
Molecular Formula C7H11N3O2S
Molecular Weight 201.246
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OVOTHIOL A

SMILES

CN1C=NC(S)=C1C[C@H](N)C(O)=O

InChI

InChIKey=XWKKYVJREGXHFO-BYPYZUCNSA-N
InChI=1S/C7H11N3O2S/c1-10-3-9-6(13)5(10)2-4(8)7(11)12/h3-4,13H,2,8H2,1H3,(H,11,12)/t4-/m0/s1

HIDE SMILES / InChI

Molecular Formula C7H11N3O2S
Molecular Weight 201.246
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 18:43:45 GMT 2023
Edited
by admin
on Sat Dec 16 18:43:45 GMT 2023
Record UNII
BJK39KC2PD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OVOTHIOL A
Common Name English
5-MERCAPTO-3-METHYL-L-HISTIDINE
Common Name English
(S)-2-AMINO-3-(4-MERCAPTO-1-METHYL-1H-IMIDAZOL-5-YL)PROPANOIC ACID
Systematic Name English
L-HISTIDINE, 5-MERCAPTO-3-METHYL-
Common Name English
L-OVOTHIOL A
Common Name English
Code System Code Type Description
WIKIPEDIA
Ovothiol A
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
CAS
108418-13-9
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
CHEBI
82723
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID90910720
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
CHEBI
83318
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
PUBCHEM
130131
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY
FDA UNII
BJK39KC2PD
Created by admin on Sat Dec 16 18:43:45 GMT 2023 , Edited by admin on Sat Dec 16 18:43:45 GMT 2023
PRIMARY