3,6,20-Cevanetriol; (3β,5α,17β)-form, 6-Ketone, N-oxide
AlkaPlorer ID: AK292025
Synonym: Imperialine N-oxide
IUPAC Name: 10,20-dihydroxy-6,10,23-trimethyl-4-oxido-4-azoniahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one
Structure
SMILES: CC1CCC2C(C)(O)C3CCC4C(CC5C4CC(=O)C4CC(O)CCC45C)C3C[N+]2([O-])C1
InChI: InChI=1S/C27H43NO4/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25,32)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3
InChIKey: RTQDXHMAHWNJLQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Fritillaria | Fritillariidae | Copelata | Appendicularia | Chordata | Metazoa | Eukaryota |
| None | Fritillaria | Fritillariidae | Copelata | Appendicularia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 445.6440000000003
TPSA？: 80.59
MolLogP？: 3.898900000000003
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|