Crepidamine

AlkaPlorer ID: AK293192

Synonym: 1-(Octahydro-6-hydroxy-7-methyl-6-phenyl-5-indolizinyl)-2-propanone

IUPAC Name: 1-(6-hydroxy-7-methyl-6-phenyl-2,3,5,7,8,8a-hexahydro-1H-indolizin-5-yl)propan-2-one

Structure

SMILES: CC(=O)CC1N2CCCC2CC(C)C1(O)C1=CC=CC=C1

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InChI: InChI=1S/C18H25NO2/c1-13-11-16-9-6-10-19(16)17(12-14(2)20)18(13,21)15-7-4-3-5-8-15/h3-5,7-8,13,16-17,21H,6,9-12H2,1-2H3

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InChIKey: FSRWSNKMDQDICY-UHFFFAOYSA-N

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Reference

PubChem CID: 587833

COCONUT: CNP0147377.1

Source

Properties Information

Molecule Weight: 287.403

TPSA: 40.540000000000006

MolLogP: 2.726100000000001

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information