Solanocapsine; 7β-Hydroxy, Me ether
AlkaPlorer ID: AK313755
Synonym: 7-Hydroxy-O-methylsolanocapsine
IUPAC Name: 7-amino-22-methoxy-10,14,16,20-tetramethyl-23-oxa-18-azahexacyclo[12.11.0.02,11.05,10.015,24.017,22]pentacosan-3-ol
Structure
SMILES: COC12CC(C)CNC1C(C)C1C(CC3C4C(O)CC5CC(N)CCC5(C)C4CCC31C)O2
InChI: InChI=1S/C28H48N2O3/c1-15-13-28(32-5)25(30-14-15)16(2)24-22(33-28)12-20-23-19(7-9-27(20,24)4)26(3)8-6-18(29)10-17(26)11-21(23)31/h15-25,30-31H,6-14,29H2,1-5H3
InChIKey: MINWXMCVTBYDGJ-UHFFFAOYSA-N
Reference
7β-Hydroxy-O-methylsolanocapsine, a new 3-amino steroidal alkaloid from Solanum capsicastrum
PubChem CID: 73802045
LOTUS: LTS0158495
COCONUT: CNP0137986.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Solanum capsicastrum | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 460.7030000000004
TPSA？: 76.74
MolLogP？: 3.9289000000000014
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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