Schizanthine X
AlkaPlorer ID: AK201276
Synonym: '(-)-Schizanthine X'
IUPAC Name: 1-O-[(1S,3R,5R,6S)-8-methyl-3-[(Z)-2-methylbut-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-6-yl] 4-O-[(1R,3S,5S,6R)-8-methyl-6-[(Z)-2-methylbut-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl] (E)-2-methylbut-2-enedioate
Structure
SMILES: C/C=C(/C)C(=O)O[C@@H]1C[C@H]2C[C@H](OC(=O)/C(C)=C/C(=O)O[C@H]3C[C@@H]4C[C@@H](OC(=O)/C(C)=C\C)[C@H](C3)N4C)[C@@H](C1)N2C
InChI: InChI=1S/C31H44N2O8/c1-8-17(3)29(35)39-23-12-21-14-27(25(16-23)33(21)7)41-31(37)19(5)10-28(34)38-22-11-20-13-26(24(15-22)32(20)6)40-30(36)18(4)9-2/h8-10,20-27H,11-16H2,1-7H3/b17-8-,18-9-,19-10+/t20-,21+,22+,23-,24+,25-,26-,27+/m1/s1
InChIKey: FMKXPBXTSXPJJS-HYOGKRSNSA-N
Reference
Schizanthine X, a New Alkaloid from Schizanthus grahamii
PubChem CID: 163104009
LOTUS: LTS0246860
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schizanthus grahamii | Schizanthus | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 572.6990000000002
TPSA？: 111.68
MolLogP？: 3.245300000000002
Number of H-Donors: 0
Number of H-Acceptors: 10
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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