α-Erythroidine; 8-Oxo

AlkaPlorer ID: AK297863

Synonym: 8-Oxo-α-erythroidine

IUPAC Name: 16-methoxy-5-oxa-10-azatetracyclo[8.7.0.01,13.02,7]heptadeca-2,12,14-triene-4,11-dione

Structure

SMILES: COC1C=CC2=CC(=O)N3CCC4COC(=O)C=C4C23C1

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InChI: InChI=1S/C16H17NO4/c1-20-12-3-2-11-6-14(18)17-5-4-10-9-21-15(19)7-13(10)16(11,17)8-12/h2-3,6-7,10,12H,4-5,8-9H2,1H3

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InChIKey: NMFUSYUBPJMLRH-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 287.315

TPSA: 55.84

MolLogP: 0.9717999999999998

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information