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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22O3
Molecular Weight 310.3869
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Yakuchinone B

SMILES

COC1=C(O)C=CC(\C=C\C(=O)CCCCC2=CC=CC=C2)=C1

InChI

InChIKey=OKVCTOBWIAGOMR-ACCUITESSA-N
InChI=1S/C20H22O3/c1-23-20-15-17(12-14-19(20)22)11-13-18(21)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,11-15,22H,5-6,9-10H2,1H3/b13-11+

HIDE SMILES / InChI

Approval Year

Name Type Language
Yakuchinone B
Common Name English
1-Hepten-3-one, 1-(4-hydroxy-3-methoxyphenyl)-7-phenyl-
Systematic Name English
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-1-hepten-3-one
Systematic Name English
1-Hepten-3-one, 1-(4-hydroxy-3-methoxyphenyl)-7-phenyl-, (1E)-
Systematic Name English
(1E)-1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-1-hepten-3-one
Systematic Name English
Code System Code Type Description
PUBCHEM
6440365
Created by admin on Sat Dec 16 20:09:00 GMT 2023 , Edited by admin on Sat Dec 16 20:09:00 GMT 2023
PRIMARY
FDA UNII
J8L7BX8M7S
Created by admin on Sat Dec 16 20:09:00 GMT 2023 , Edited by admin on Sat Dec 16 20:09:00 GMT 2023
PRIMARY
CAS
81840-57-5
Created by admin on Sat Dec 16 20:09:00 GMT 2023 , Edited by admin on Sat Dec 16 20:09:00 GMT 2023
PRIMARY
CAS
105955-06-4
Created by admin on Sat Dec 16 20:09:00 GMT 2023 , Edited by admin on Sat Dec 16 20:09:00 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY