Strychnofendlerine; 11-Methoxy, 12-hydroxy, 20,21-didehydro

AlkaPlorer ID: AK314616

Synonym: 12-Hydroxy-11-methoxystrychnobrasiline

IUPAC Name: 8-acetyl-6-hydroxy-5-methoxy-13,16-dimethyl-12-oxa-8,16-diazapentacyclo[8.8.3.01,9.02,7.014,21]henicosa-2(7),3,5,14-tetraen-19-one

Structure

SMILES: COC1=C(O)C2=C(C=C1)C13CCN(C)C=C4C(C)OCC(C4CC1=O)C3N2C(C)=O

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InChI: InChI=1S/C23H28N2O5/c1-12-15-10-24(3)8-7-23-17-5-6-18(29-4)21(28)20(17)25(13(2)26)22(23)16(11-30-12)14(15)9-19(23)27/h5-6,10,12,14,16,22,28H,7-9,11H2,1-4H3

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InChIKey: YBZBDOKOKXHVDG-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 412.48600000000016

TPSA: 79.31

MolLogP: 2.217

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information