Deacetyllycoclavine; 5-O-[3-(3,4-Dimethoxyphenyl)propanoyl]
AlkaPlorer ID: AK294504
Synonym: Lycognidine
IUPAC Name: (12-hydroxy-15-methyl-6-azatetracyclo[8.6.0.01,6.02,13]hexadecan-11-yl) 3-(3,4-dimethoxyphenyl)propanoate
Structure
SMILES: COC1=CC=C(CCC(=O)OC2C(O)C3CC(C)CC45C3CCCN4CCCC25)C=C1OC
InChI: InChI=1S/C27H39NO5/c1-17-14-19-20-6-4-12-28-13-5-7-21(27(20,28)16-17)26(25(19)30)33-24(29)11-9-18-8-10-22(31-2)23(15-18)32-3/h8,10,15,17,19-21,25-26,30H,4-7,9,11-14,16H2,1-3H3
InChIKey: VMROWFMMJYXYBW-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Lycopodium | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
| Phlegmariurus fargesii | Phlegmariurus | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Lycopodium | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 457.6110000000004
TPSA？: 68.23
MolLogP？: 3.829600000000003
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|