Protopine; 13-Oxo

AlkaPlorer ID: AK263188

Synonym: 13-Oxoprotopine, 14-Oxoprotopine, Oxyprotopine

IUPAC Name: 15-methyl-7,9,19,21-tetraoxa-15-azapentacyclo[15.7.0.04,12.06,10.018,22]tetracosa-1(17),4,6(10),11,18(22),23-hexaene-2,3-dione

Structure

SMILES: CN1CCC2=CC3=C(C=C2C(=O)C(=O)C2=CC=C4OCOC4=C2C1)OCO3

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InChI: InChI=1S/C20H17NO6/c1-21-5-4-11-6-16-17(26-9-25-16)7-13(11)19(23)18(22)12-2-3-15-20(14(12)8-21)27-10-24-15/h2-3,6-7H,4-5,8-10H2,1H3

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InChIKey: MVLGCIMOMXBFEG-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 367.3570000000002

TPSA: 74.30000000000001

MolLogP: 2.1975

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information