Daphnicyclidin E
AlkaPlorer ID: AK486481
Synonym: None
IUPAC Name: methyl (4S,5S,9S,10S)-5,9-dimethyl-2-oxo-14-oxa-7-azoniahexacyclo[15.2.1.17,10.04,8.09,19.013,18]henicosa-1(19),7,13(18),17(20)-tetraene-20-carboxylate
Structure
SMILES: COC(=O)C1=C2CCOC3=C2C2=C1C(=O)C[C@@H]1C4=[N+](C[C@@H](CC3)[C@@]24C)C[C@H]1C
InChI: InChI=1S/C23H26NO4/c1-11-9-24-10-12-4-5-16-17-13(6-7-28-16)18(22(26)27-3)19-15(25)8-14(11)21(24)23(12,2)20(17)19/h11-12,14H,4-10H2,1-3H3/q+1/t11-,12-,14+,23+/m1/s1
InChIKey: PCQQWJNGXKUBRU-OHTLTYMQSA-N
Reference
Daphnicyclidins J and K, Unique Polycyclic Alkaloids from <i>Daphniphyllum </i><i>h</i><i>umile</i>
PubChem CID: 102305514
LOTUS: LTS0169157
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Daphniphyllum macropodum | Daphniphyllum | Daphniphyllaceae | Saxifragales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 380.4640000000002
TPSA？: 55.61
MolLogP？: 2.5627000000000004
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|