Mesembrenol; (+)-form, 7,7a-Didehydro, 6-ketone 

AlkaPlorer ID: AK305624

Synonym: 7,7a-Didehydromesembrenone 

IUPAC Name: None

Structure

SMILES: COC1=CC=C(C23C=CC(=O)C=C2N(C)CC3)C=C1OC

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InChI: InChI=1S/C17H19NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-7,10-11H,8-9H2,1-3H3

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InChIKey: ZQCUVJCFAPGXBI-UHFFFAOYSA-N

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Reference

CAS: 1466437-69-3

Source

Properties Information

Molecule Weight: 285.343

TPSA: 38.77

MolLogP: 2.2999

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information