Cepharadione B; O2-De-Me 

AlkaPlorer ID: AK020366

Synonym: Aristolodione, Piperadione

IUPAC Name: 15-hydroxy-16-methoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene-11,12-dione

Structure

SMILES: COC1=C(O)C=C2C(=O)C(=O)N(C)C3=CC4=CC=CC=C4C1=C23

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InChI: InChI=1S/C18H13NO4/c1-19-12-7-9-5-3-4-6-10(9)15-14(12)11(16(21)18(19)22)8-13(20)17(15)23-2/h3-8,20H,1-2H3

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InChIKey: JGDZUWXHWYXMSD-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 307.30500000000006

TPSA: 66.84

MolLogP: 2.8663000000000016

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information