Strychnofendlerine; 10,11-Dimethoxy, 20,21-didehydro

AlkaPlorer ID: AK314611

Synonym: 10,11-Dimethoxystrychnobrasiline

IUPAC Name: 8-acetyl-4,5-dimethoxy-13,16-dimethyl-12-oxa-8,16-diazapentacyclo[8.8.3.01,9.02,7.014,21]henicosa-2,4,6,14-tetraen-19-one

Structure

SMILES: COC1=CC2=C(C=C1OC)C13CCN(C)C=C4C(C)OCC(C4CC1=O)C3N2C(C)=O

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InChI: InChI=1S/C24H30N2O5/c1-13-16-11-25(3)7-6-24-18-9-20(29-4)21(30-5)10-19(18)26(14(2)27)23(24)17(12-31-13)15(16)8-22(24)28/h9-11,13,15,17,23H,6-8,12H2,1-5H3

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InChIKey: MERDGTCHMHALDP-UHFFFAOYSA-N

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Reference

PubChem CID: 162998839

COCONUT: CNP0272442.1

Source

Properties Information

Molecule Weight: 426.5130000000002

TPSA: 68.31

MolLogP: 2.5200000000000005

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information