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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H20O4
Molecular Weight 324.3704
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ISOBAVACHALCONE

SMILES

CC(C)=CCC1=C(O)C(=CC=C1O)C(=O)\C=C\C2=CC=C(O)C=C2

InChI

InChIKey=DUWPGRAKHMEPCM-IZZDOVSWSA-N
InChI=1S/C20H20O4/c1-13(2)3-9-16-19(23)12-10-17(20(16)24)18(22)11-6-14-4-7-15(21)8-5-14/h3-8,10-12,21,23-24H,9H2,1-2H3/b11-6+

HIDE SMILES / InChI

Approval Year

Name Type Language
ISOBAVACHALCONE
INCI  
Official Name English
2-PROPEN-1-ONE, 1-(2,4-DIHYDROXY-3-(3-METHYL-2-BUTEN-1-YL)PHENYL)-3-(4-HYDROXYPHENYL)-, (2E)-
Systematic Name English
2-PROPEN-1-ONE, 1-(2,4-DIHYDROXY-3-(3-METHYL-2-BUTENYL)PHENYL)-3-(4-HYDROXYPHENYL)-, (2E)-
Systematic Name English
4-HYDROXYISOCORDOIN
Common Name English
CORYLIFOLININ
Common Name English
(2E)-1-(2,4-DIHYDROXY-3-(3-METHYL-2-BUTENYL)PHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE
Systematic Name English
ISOBACACHALCONE
Common Name English
CHALCONE, 2',4,4'-TRIHYDROXY-3'-(3-METHYL-2-BUTENYL)-
Common Name English
ISOBAVACHALCONE [INCI]
Common Name English
Code System Code Type Description
CAS
54676-49-2
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID601317123
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
PRIMARY
CHEBI
28106
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
PRIMARY
CAS
20784-50-3
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
PRIMARY
PUBCHEM
5281255
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
PRIMARY
FDA UNII
ZWO2SC993A
Created by admin on Sat Dec 16 19:58:51 GMT 2023 , Edited by admin on Sat Dec 16 19:58:51 GMT 2023
PRIMARY