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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H21NO9S3
Molecular Weight 407.481
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GLUCOIBERVIRIN

SMILES

CSCCCC(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS(O)(=O)=O

InChI

InChIKey=ZCZCVJVUJGULMO-BZVDQRPCSA-N
InChI=1S/C11H21NO9S3/c1-22-4-2-3-7(12-21-24(17,18)19)23-11-10(16)9(15)8(14)6(5-13)20-11/h6,8-11,13-16H,2-5H2,1H3,(H,17,18,19)/b12-7+/t6-,8-,9+,10-,11+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
GLUCOIBERVIRIN
Common Name English
.BETA.-D-GLUCOPYRANOSE, 1-THIO-, 1-(4-(METHYLTHIO)-N-(SULFOOXY)BUTANIMIDATE)
Common Name English
3-METHYLTHIOPROPYL GLUCOSINOLATE
Common Name English
Code System Code Type Description
FDA UNII
5TAV30MLR4
Created by admin on Fri Dec 15 19:41:28 GMT 2023 , Edited by admin on Fri Dec 15 19:41:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID60949683
Created by admin on Fri Dec 15 19:41:28 GMT 2023 , Edited by admin on Fri Dec 15 19:41:28 GMT 2023
PRIMARY
PUBCHEM
656545
Created by admin on Fri Dec 15 19:41:28 GMT 2023 , Edited by admin on Fri Dec 15 19:41:28 GMT 2023
PRIMARY
CAS
26888-03-9
Created by admin on Fri Dec 15 19:41:28 GMT 2023 , Edited by admin on Fri Dec 15 19:41:28 GMT 2023
PRIMARY
CHEBI
79326
Created by admin on Fri Dec 15 19:41:28 GMT 2023 , Edited by admin on Fri Dec 15 19:41:28 GMT 2023
PRIMARY