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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H18O6
Molecular Weight 366.364
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GLYCYROL

SMILES

COC1=C2C3=C(C4=C(O3)C=C(O)C=C4)C(=O)OC2=CC(O)=C1CC=C(C)C

InChI

InChIKey=LWESBHWAOZORCQ-UHFFFAOYSA-N
InChI=1S/C21H18O6/c1-10(2)4-6-12-14(23)9-16-18(19(12)25-3)20-17(21(24)27-16)13-7-5-11(22)8-15(13)26-20/h4-5,7-9,22-23H,6H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
GLYCYROL
Common Name English
3,9-DIHYDROXY-1-METHOXY-2-(3-METHYL-2-BUTEN-1-YL)-6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-6-ONE
Systematic Name English
6H-BENZOFURO(3,2-C)(1)BENZOPYRAN-6-ONE, 3,9-DIHYDROXY-1-METHOXY-2-(3-METHYL-2-BUTEN-1-YL)-
Systematic Name English
NEOGLYCYROL
Common Name English
Code System Code Type Description
CAS
23013-84-5
Created by admin on Sat Dec 16 09:40:13 GMT 2023 , Edited by admin on Sat Dec 16 09:40:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID00177569
Created by admin on Sat Dec 16 09:40:13 GMT 2023 , Edited by admin on Sat Dec 16 09:40:13 GMT 2023
PRIMARY
CHEBI
80832
Created by admin on Sat Dec 16 09:40:13 GMT 2023 , Edited by admin on Sat Dec 16 09:40:13 GMT 2023
PRIMARY
PUBCHEM
5320083
Created by admin on Sat Dec 16 09:40:13 GMT 2023 , Edited by admin on Sat Dec 16 09:40:13 GMT 2023
PRIMARY
FDA UNII
6C3DSA537F
Created by admin on Sat Dec 16 09:40:13 GMT 2023 , Edited by admin on Sat Dec 16 09:40:13 GMT 2023
PRIMARY