Beiwusine B
AlkaPlorer ID: AK575778
Synonym: None
IUPAC Name: 15,18-dihydroxy-13-(2-hydroxyethyl)-11-methyl-19-methylidene-13-azapentacyclo[9.3.3.24,7.01,10.02,7]nonadecan-6-one
Structure
SMILES: C=C1C2CC(=O)C3(CCC4C5(C)CCC(O)C4(CN(CCO)C5)C3C2)C1O
InChI: InChI=1S/C22H33NO4/c1-13-14-9-16-21(19(13)27,18(26)10-14)6-3-15-20(2)5-4-17(25)22(15,16)12-23(11-20)7-8-24/h14-17,19,24-25,27H,1,3-12H2,2H3
InChIKey: XWUKPLHDKUEVSQ-UHFFFAOYSA-N
Reference
Two New Diterpenoid Alkaloids, Beiwusines A and B, from<i>Aconitum kusnezoffii</i>
PubChem CID: 163106648
CAS: 224790-29-8
LOTUS: LTS0110755
COCONUT: CNP0426601.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum kusnezoffii | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 375.5090000000001
TPSA？: 81.0
MolLogP？: 1.3640999999999996
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|