4-Methylaconitane-1,8,10,14,16,18-hexol; (1α,14α,16β)-form, 14-Ketone, O16,O18-di-Me, N-Et
AlkaPlorer ID: AK305827
Synonym: Genicunine C
IUPAC Name: None
Structure
SMILES: CCN1CC2(COC)CCC(O)C34C1C(CC23)C1(O)CC(OC)C2CC4(O)C1C2=O
InChI: InChI=1S/C23H35NO6/c1-4-24-10-20(11-29-2)6-5-16(25)23-15(20)7-13(19(23)24)21(27)9-14(30-3)12-8-22(23,28)18(21)17(12)26/h12-16,18-19,25,27-28H,4-11H2,1-3H3
InChIKey: KEXMVHJSJAENHW-UHFFFAOYSA-N
Reference
CAS: 287186-11-2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum geniculatum | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 421.5340000000002
TPSA？: 99.46
MolLogP？: 0.2002000000000008
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|