Terpendole H

AlkaPlorer ID: AK070366

Synonym: '', 'Terpendole H'

IUPAC Name: (1R,2S,5S,7R,8R,9R,11S,12R,14S,16S)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6,10,13-trioxa-25-azaoctacyclo[14.10.0.02,12.05,11.09,11.012,14.018,26.019,24]hexacosa-18(26),19,21,23-tetraen-8-ol

Structure

SMILES: CC(C)(O)[C@@H]1O[C@H]2CC[C@]3(C)[C@]4(O[C@H]4C[C@@H]4CC5=C(NC6=CC=CC=C56)[C@]43C)[C@]23O[C@@H]3[C@@H]1O

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InChI: InChI=1S/C27H33NO5/c1-23(2,30)21-19(29)22-26(33-22)17(31-21)9-10-24(3)25(4)13(12-18-27(24,26)32-18)11-15-14-7-5-6-8-16(14)28-20(15)25/h5-8,13,17-19,21-22,28-30H,9-12H2,1-4H3/t13-,17-,18-,19+,21+,22+,24-,25-,26-,27-/m0/s1

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InChIKey: OAZQOSOFFNLFEK-FGHQPUNZSA-N

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Source

Properties Information

Molecule Weight: 451.5630000000001

TPSA: 90.54

MolLogP: 2.976100000000002

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information