epi-Bisdehydroneotuberostemonine J

AlkaPlorer ID: AK012849

Synonym: '', 'Arcyriarubin A', 'bisdehydrotuberostemonine D', 'bisdehydrotuberostemonine E', '(-)-epi-Bisdehydroneotuberostemonine J', 'bisindolylmaleimide IV', 'Didehydrotuberostemonine'

IUPAC Name: (9R,10R,11S,14R,15R)-10-ethyl-14-methyl-3-[(2R,4S)-4-methyl-5-oxooxolan-2-yl]-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadeca-1(16),2-dien-13-one

Structure

SMILES: CC[C@H]1[C@@H]2OC(=O)[C@H](C)[C@@H]2C2=C3[C@@H]1CCCCN3C([C@H]1C[C@H](C)C(=O)O1)=C2

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InChI: InChI=1S/C22H29NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h10-14,17-18,20H,4-9H2,1-3H3/t11-,12+,13+,14+,17+,18+,20-/m0/s1

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InChIKey: RFGMIDHPFYCJDM-XJCILQKWSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Stemona tuberosa Stemona Stemonaceae Pandanales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 371.4770000000001

TPSA: 57.53

MolLogP: 4.064600000000003

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information