17-Oxolupanine; 13ξ-Hydroxy

AlkaPlorer ID: AK308973

Synonym: 13-Hydroxy-17-oxolupanine

IUPAC Name: None

Structure

SMILES: O=C1C2CC(CN3C(=O)CCCC23)C2CC(O)CCN12

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InChI: InChI=1S/C15H22N2O3/c18-10-4-5-16-13(7-10)9-6-11(15(16)20)12-2-1-3-14(19)17(12)8-9/h9-13,18H,1-8H2

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InChIKey: BFMDPWUKHHLHDK-UHFFFAOYSA-N

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Reference

CAS: 152406-63-8

Properties Information

Molecule Weight: 278.352

TPSA: 60.85

MolLogP: 0.3690999999999996

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information