Solanocapsine
AlkaPlorer ID: AK313752
Synonym: 3-Amino-16,23-epoxy-16,28-secosolanidan-23-ol, 3-Amino-22,26-epimino-16,23-epoxycholestan-23-ol
IUPAC Name: 7-amino-10,14,16,20-tetramethyl-23-oxa-18-azahexacyclo[12.11.0.02,11.05,10.015,24.017,22]pentacosan-22-ol
Structure
SMILES: CC1CNC2C(C)C3C(CC4C5CCC6CC(N)CCC6(C)C5CCC43C)OC2(O)C1
InChI: InChI=1S/C27H46N2O2/c1-15-13-27(30)24(29-14-15)16(2)23-22(31-27)12-21-19-6-5-17-11-18(28)7-9-25(17,3)20(19)8-10-26(21,23)4/h15-24,29-30H,5-14,28H2,1-4H3
InChIKey: ZPTJKUUQUDRHTL-UHFFFAOYSA-N
Reference
Steroidal Alkaloids and Sapogenins from Roots of Some<i>Solanum</i>Species<sup>1</sup>
PubChem CID: 423221
LOTUS: LTS0122078
COCONUT: CNP0274862.5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Solanum capsicastrum | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Solanum pseudocapsicum | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 430.6770000000003
TPSA？: 67.51
MolLogP？: 4.304000000000004
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|