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CRDB_AN000021

PubChem Compound ID CID10450340
CRDB ID CRDB_AN000021
Molecular Formula C22H34O3
IUPAC Name (E)-1-(4-hydroxy-3-methoxyphenyl)pentadec-4-en-3-one
IUPAC CAS Name (E)-1-(4-hydroxy-3-methoxyphenyl)-4-pentadecen-3-one
IUPAC Traditional Name (E)-1-(4-hydroxy-3-methoxy-phenyl)pentadec-4-en-3-one
Common Name NA
SMILES CCCCCCCCCCC=CC(=O)CCC1=CC(=C(C=C1)O)OC
2D Structure
Molecular Weight 346.50356
Exact Mass 346.250795
TPSA 46.5
XLOGP3_AA
H-Bond Donor 1
H-Bond Acceptor 3
Rotatable Bond 14
Heavy Atom Count 25
Tautomer Count 15
Total Charge 0
Author 0
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