4-Methylaconit-19(N)-ene-1,8,14,16-tetrol; (1α,14α,16β)-form, O1,O8,O16-Tri-Me
AlkaPlorer ID: AK305849
Synonym: Vilmorrianine G
IUPAC Name: None
Structure
SMILES: COC1CC2(OC)C3CC4C5(C)C=NC3C4(C(OC)CC5)C3CC1C(O)C32
InChI: InChI=1S/C22H33NO4/c1-20-6-5-16(26-3)22-12-7-11-14(25-2)9-21(27-4,17(12)18(11)24)13(8-15(20)22)19(22)23-10-20/h10-19,24H,5-9H2,1-4H3
InChIKey: ASBWPCCUPAWMTN-UHFFFAOYSA-N
Reference
CAS: 2027580-91-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum vilmorinianum | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 375.5090000000002
TPSA？: 60.28
MolLogP？: 2.3077
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|