Dihydrogambirtannine; (ξ)-form, De(methoxycarbonyl), 15,16,17,18-tetrahydro

AlkaPlorer ID: AK207911

Synonym: Demethoxycarbonyl-3,4,15,16,17,18-hexahydrogambirtannine

IUPAC Name: 1,3,11,12,14,17,18,19,20,21-decahydroyohimban

Structure

SMILES: C1=C2CN3CCC4=C(NC5=CC=CC=C45)C3CC2CCC1

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InChI: InChI=1S/C19H22N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h3-4,6-8,13,18,20H,1-2,5,9-12H2

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InChIKey: ILWYXIUNTQZXOW-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 278.39900000000006

TPSA: 19.03

MolLogP: 4.197300000000003

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information