Annofoline

AlkaPlorer ID: AK015162

Synonym: '', 'Annofoline'

IUPAC Name: (1R,2R,10S,11R,13S,15R)-11-hydroxy-15-methyl-6-azatetracyclo[8.6.0.01,6.02,13]hexadecan-14-one

Structure

SMILES: C[C@@H]1C[C@@]23[C@@H]4CCCN2CCC[C@@H]3[C@H](C[C@H]4O)C1=O

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InChI: InChI=1S/C16H25NO2/c1-10-9-16-12-4-2-6-17(16)7-3-5-13(16)14(18)8-11(12)15(10)19/h10-14,18H,2-9H2,1H3/t10-,11+,12-,13-,14-,16-/m1/s1

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InChIKey: KYIYXWHVYGBAKF-NVWMEEMDSA-N

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Source

Properties Information

Molecule Weight: 263.381

TPSA: 40.54

MolLogP: 1.8369

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