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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H20N2O3
Molecular Weight 228.2881
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESTHIOBIOTIN METHYL ESTER

SMILES

COC(=O)CCCCC[C@H]1NC(=O)N[C@H]1C

InChI

InChIKey=VFHYOHZGJXDMKX-DTWKUNHWSA-N
InChI=1S/C11H20N2O3/c1-8-9(13-11(15)12-8)6-4-3-5-7-10(14)16-2/h8-9H,3-7H2,1-2H3,(H2,12,13,15)/t8-,9+/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H20N2O3
Molecular Weight 228.2881
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:04:01 GMT 2023
Edited
by admin
on Sat Dec 16 08:04:01 GMT 2023
Record UNII
K7H04D5E8G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESTHIOBIOTIN METHYL ESTER
MI  
Common Name English
4-IMIDAZOLIDINEHEXANOIC ACID, 5-METHYL-2-OXO-, METHYL ESTER, (4R,5S)-
Systematic Name English
4-IMIDAZOLIDINEHEXANOIC ACID, 5-METHYL-2-OXO-, METHYL ESTER, CIS-(+)-
Common Name English
DESTHIOBIOTIN, METHYL ESTER
Common Name English
DESTHIOBIOTIN METHYL ESTER [MI]
Common Name English
Code System Code Type Description
CAS
6020-51-5
Created by admin on Sat Dec 16 08:04:01 GMT 2023 , Edited by admin on Sat Dec 16 08:04:01 GMT 2023
PRIMARY
MERCK INDEX
m4205
Created by admin on Sat Dec 16 08:04:01 GMT 2023 , Edited by admin on Sat Dec 16 08:04:01 GMT 2023
PRIMARY Merck Index
FDA UNII
K7H04D5E8G
Created by admin on Sat Dec 16 08:04:01 GMT 2023 , Edited by admin on Sat Dec 16 08:04:01 GMT 2023
PRIMARY
PUBCHEM
11229925
Created by admin on Sat Dec 16 08:04:01 GMT 2023 , Edited by admin on Sat Dec 16 08:04:01 GMT 2023
PRIMARY