Comosivine; O18-De-Me 

AlkaPlorer ID: AK292864

Synonym: Athrocupressine

IUPAC Name: 4,5,17-trimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraen-6-ol

Structure

SMILES: COC1=C(OC)C(O)=C2CCCN3CCC4=CCC(OC)CC43C2=C1

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InChI: InChI=1S/C20H27NO4/c1-23-14-7-6-13-8-10-21-9-4-5-15-16(20(13,21)12-14)11-17(24-2)19(25-3)18(15)22/h6,11,14,22H,4-5,7-10,12H2,1-3H3

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InChIKey: SKUMEWDHLGQJQB-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 345.439

TPSA: 51.16

MolLogP: 2.9918000000000013

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information