3alpha-Hydroxylupanine

AlkaPlorer ID: AK026641

Synonym: '', '3beta-Hydroxylupanine'

IUPAC Name: (1R,2R,5R,9R,10S)-5-hydroxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one

Structure

SMILES: O=C1[C@H](O)CC[C@@H]2[C@@H]3C[C@H](CN12)[C@@H]1CCCCN1C3

copy

InChI: InChI=1S/C15H24N2O2/c18-14-5-4-13-10-7-11(9-17(13)15(14)19)12-3-1-2-6-16(12)8-10/h10-14,18H,1-9H2/t10-,11-,12+,13-,14-/m1/s1

copy

InChIKey: FROKOSJUHZENQC-RKQHYHRCSA-N

copy

Source

Properties Information

Molecule Weight: 264.369

TPSA: 43.78

MolLogP: 0.8425

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