Deacetyllycoclavine; 5-O-[3-(3,4-Dimethoxyphenyl)propanoyl], N-oxide
AlkaPlorer ID: AK294505
Synonym: Fargesiine C
IUPAC Name: None
Structure
SMILES: COC1=CC=C(CCC(=O)OC2C(O)C3CC(C)CC45C3CCC[N+]4([O-])CCCC25)C=C1OC
InChI: InChI=1S/C27H39NO6/c1-17-14-19-20-6-4-12-28(31)13-5-7-21(27(20,28)16-17)26(25(19)30)34-24(29)11-9-18-8-10-22(32-2)23(15-18)33-3/h8,10,15,17,19-21,25-26,30H,4-7,9,11-14,16H2,1-3H3
InChIKey: IONHEIZCFLGUCN-UHFFFAOYSA-N
Reference
CAS: 1902161-56-1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phlegmariurus fargesii | Phlegmariurus | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 473.6100000000004
TPSA？: 88.05000000000001
MolLogP？: 3.8422000000000014
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|