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CRDB_AN000008

PubChem Compound ID CID10200979
CRDB ID CRDB_AN000008
Molecular Formula C21H20O8
IUPAC Name (1E,6E)-1,7-bis(3,4-dihydroxy-5-methoxyphenyl)hepta-1,6-diene-3,5-dione
IUPAC CAS Name (1E,6E)-1,7-bis(3,4-dihydroxy-5-methoxyphenyl)hepta-1,6-diene-3,5-dione
IUPAC Traditional Name (1E,6E)-1,7-bis(3,4-dihydroxy-5-methoxy-phenyl)hepta-1,6-diene-3,5-dione
Common Name NA
SMILES COC1=CC(=CC(=C1O)O)C=CC(=O)CC(=O)C=CC2=CC(=C(C(=C2)OC)O)O
2D Structure
Molecular Weight 400.3787
Exact Mass 400.115818
TPSA 134
XLOGP3_AA 2.5
H-Bond Donor 4
H-Bond Acceptor 8
Rotatable Bond 8
Heavy Atom Count 29
Tautomer Count 344
Total Charge 0
Author 0
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