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

Details

Stereochemistry RACEMIC
Molecular Formula C20H20O5
Molecular Weight 340.3698
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-DEOXYKIEVITONE

SMILES

CC(C)=CCC1=C2OCC(C(=O)C2=CC=C1O)C3=C(O)C=C(O)C=C3

InChI

InChIKey=JIJYZALGIIQXKE-UHFFFAOYSA-N
InChI=1S/C20H20O5/c1-11(2)3-5-14-17(22)8-7-15-19(24)16(10-25-20(14)15)13-6-4-12(21)9-18(13)23/h3-4,6-9,16,21-23H,5,10H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
5-DEOXYKIEVITONE
Common Name English
(±)-5-DEOXYKIEVITONE
Common Name English
4H-1-BENZOPYRAN-4-ONE, 3-(2,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-7-HYDROXY-8-(3-METHYL-2-BUTENYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80331945
Created by admin on Sat Dec 16 11:56:02 GMT 2023 , Edited by admin on Sat Dec 16 11:56:02 GMT 2023
PRIMARY
CAS
105817-02-5
Created by admin on Sat Dec 16 11:56:02 GMT 2023 , Edited by admin on Sat Dec 16 11:56:02 GMT 2023
ALTERNATIVE
PUBCHEM
442770
Created by admin on Sat Dec 16 11:56:02 GMT 2023 , Edited by admin on Sat Dec 16 11:56:02 GMT 2023
PRIMARY
CAS
74161-24-3
Created by admin on Sat Dec 16 11:56:02 GMT 2023 , Edited by admin on Sat Dec 16 11:56:02 GMT 2023
PRIMARY
FDA UNII
01J606C35G
Created by admin on Sat Dec 16 11:56:02 GMT 2023 , Edited by admin on Sat Dec 16 11:56:02 GMT 2023
PRIMARY