World’s first comprehensive online database on Curcumin

CRDB_AN000019

PubChem Compound ID CID10429233
CRDB ID CRDB_AN000019
Molecular Formula C21H22O6
IUPAC Name (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3,5-dione
IUPAC CAS Name (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1-heptene-3,5-dione
IUPAC Traditional Name (E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-1-ene-3,5-dione
Common Name NA
SMILES COC1=C(C=CC(=C1)CCC(=O)CC(=O)C=CC2=CC(=C(C=C2)O)OC)O
2D Structure
Molecular Weight 370.39578
Exact Mass 370.141638
TPSA 93.1
XLOGP3_AA 3
H-Bond Donor 2
H-Bond Acceptor 6
Rotatable Bond 9
Heavy Atom Count 27
Tautomer Count 84
Total Charge 0
Author 0
Download Molecule
GI Molecular Targets NCBI Links