3,6,14,16,20-Cevanepentol; (3β,5α,6α,16ξ,20ξ)-form
AlkaPlorer ID: AK292006
Synonym: Pingpeimine A
IUPAC Name: 6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane-10,12,14,17,20-pentol
Structure
SMILES: CC1CCC2N(C1)CC1C(C(O)CC3(O)C1CC1C3CC(O)C3CC(O)CCC31C)C2(C)O
InChI: InChI=1S/C27H45NO5/c1-14-4-5-23-26(3,32)24-16(13-28(23)12-14)17-9-18-19(27(17,33)11-22(24)31)10-21(30)20-8-15(29)6-7-25(18,20)2/h14-24,29-33H,4-13H2,1-3H3
InChIKey: IDFMBIWPULRZOJ-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: 463.6590000000003
TPSA？: 104.39
MolLogP？: 1.7637999999999994
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|