Schizanthine D
AlkaPlorer ID: AK039500
Synonym: '(-)-Schizanthine D'
IUPAC Name: 1-O-[(1S,3S,5R,6S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-6-yl] 4-O-[(1R,3R,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](O)C[C@H]3N4C)C[C@@H]1N2C
InChI: InChI=1S/C26H38N2O7/c1-6-14(2)25(31)34-23-11-17-9-19(13-21(23)28(17)5)33-24(30)7-15(3)26(32)35-22-10-16-8-18(29)12-20(22)27(16)4/h6-7,16-23,29H,8-13H2,1-5H3/b14-6-,15-7+/t16-,17+,18-,19+,20+,21-,22-,23+/m0/s1
InChIKey: IWXPYZSPSNEUBJ-VPDHJAKKSA-N
Reference
Tropane alkaloids from Schizanthus grahamii
PubChem CID: 162923198
LOTUS: LTS0194866
SuperNatural Ⅲ: SN0157469-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schizanthus grahamii | Schizanthus | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 490.59700000000026
TPSA？: 105.61
MolLogP？: 1.7282000000000004
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|