Clivoline
AlkaPlorer ID: AK011914
Synonym: '', 'Clivorine', 'Clivoline'
IUPAC Name: [(1R,4Z,6R,7S,11Z)-4-ethenyl-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadeca-4,11-dien-7-yl] acetate
Structure
SMILES: C=C/C1=C/[C@@H](C)[C@](C)(OC(C)=O)C(=O)OC/C2=C/CN(C)CC[C@@H](OC1=O)C2=O
InChI: InChI=1S/C21H27NO7/c1-6-15-11-13(2)21(4,29-14(3)23)20(26)27-12-16-7-9-22(5)10-8-17(18(16)24)28-19(15)25/h6-7,11,13,17H,1,8-10,12H2,2-5H3/b15-11-,16-7-/t13-,17-,21+/m1/s1
InChIKey: LIEIOJNANXUNDT-WIOQBUNOSA-N
Reference
Pyrrolizidine alkaloids. XVI. Alkaloids from some plants of the genus Ligularia
PubChem CID: 5284370
CAS: 33979-15-6
LOTUS: LTS0185237
SuperNatural Ⅲ: SN0206146-06
NPASS: NPC107956
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ligularia hodgsonii | Ligularia | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 405.4470000000002
TPSA？: 99.21
MolLogP？: 1.3562999999999996
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|