Solaquidine
AlkaPlorer ID: AK313764
Synonym: 3,3-Dimethoxy-16,28-secosolanidane, 3,3-Dimethoxy-22,26-epiminocholestane
IUPAC Name: 2-[1-(3,3-dimethoxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)ethyl]-5-methylpiperidine
Structure
SMILES: COC1(OC)CCC2(C)C(CCC3C2CCC2(C)C(C(C)C4CCC(C)CN4)CCC32)C1
InChI: InChI=1S/C29H51NO2/c1-19-7-12-26(30-18-19)20(2)23-10-11-24-22-9-8-21-17-29(31-5,32-6)16-15-27(21,3)25(22)13-14-28(23,24)4/h19-26,30H,7-18H2,1-6H3
InChIKey: DBJXVOKDPYNCEC-UHFFFAOYSA-N
Reference
Solaquidine, a new steroidal alkaloid from Solanum pseudoquina
PubChem CID: 13891846
LOTUS: LTS0151124
COCONUT: CNP0132419.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Solanum pseudoquina | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 445.73200000000026
TPSA？: 30.49
MolLogP？: 6.658600000000008
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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