Septentriosine
AlkaPlorer ID: AK185107
Synonym: '(+)-Septentriosine'
IUPAC Name: (1R,2S,3S,5S,6R,8R,9S,11S,14S,16S,17S,18S)-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecane-2,3,6,18-tetrol
Structure
SMILES: C=C1C[C@]23C[C@H]4[C@@H]5[C@]6(C)C[C@H](O)[C@@H](O)[C@]57[C@@H]([C@H]2C[C@H]1C[C@]37O)N4[C@@H]6O
InChI: InChI=1S/C20H27NO4/c1-8-4-18-6-11-13-17(2)7-12(22)15(23)20(13)14(21(11)16(17)24)10(18)3-9(8)5-19(18,20)25/h9-16,22-25H,1,3-7H2,2H3/t9-,10+,11-,12-,13+,14+,15+,16+,17-,18-,19-,20+/m0/s1
InChIKey: FQPRSAQZPQSWKW-NZWBKAGASA-N
Reference
Septentriosine--a New C<sub>20</sub>-Diterpenoid Alkaloid from Aconitum septentrionale
PubChem CID: 162921524
LOTUS: LTS0073664
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum septentrionale | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 345.4390000000001
TPSA？: 84.16
MolLogP？: 0.2265000000000001
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|