pseudostrychnine

AlkaPlorer ID: AK005206

Synonym: '', 'SMR001570225', 'Pseudostrychnine', '16-hydroxystrychnine', 'MLSMR', '(-)-pseudostrychnine', 'MLS002703508', 'ConMedNP.1202'

IUPAC Name: (4aR,5aR,8aS,13aS,15bR)-5a-hydroxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

Structure

SMILES: O=C1CC2OCC=C3CN4CC[C@]56C7=CC=CC=C7N1[C@H]5[C@H]2[C@H]3C[C@]46O

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InChI: InChI=1S/C21H22N2O3/c24-17-9-16-18-13-10-21(25)20(6-7-22(21)11-12(13)5-8-26-16)14-3-1-2-4-15(14)23(17)19(18)20/h1-5,13,16,18-19,25H,6-11H2/t13-,16?,18-,19-,20-,21+/m0/s1

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InChIKey: HCCFPODVEOBUMM-DHHHYNEKSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Strychnos lucida Strychnos Loganiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 350.41800000000006

TPSA: 53.010000000000005

MolLogP: 1.4125

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information