None
AlkaPlorer ID: AK323772
Synonym: None
IUPAC Name: [(1S,2S,4R,11R,12S,14R,15R,16S)-15-hydroxy-16-methyl-3-oxa-7-azapentacyclo[9.6.0.01,7.02,4.02,14]heptadecan-12-yl] 3-(4-hydroxyphenyl)propanoate
Structure
SMILES: C[C@H]1C[C@@]23[C@H]4CCCN2CC[C@H]2O[C@]23[C@H](C[C@@H]4OC(=O)CCC2=CC=C(O)C=C2)[C@@H]1O
InChI: InChI=1S/C25H33NO5/c1-15-14-24-18-3-2-11-26(24)12-10-21-25(24,31-21)19(23(15)29)13-20(18)30-22(28)9-6-16-4-7-17(27)8-5-16/h4-5,7-8,15,18-21,23,27,29H,2-3,6,9-14H2,1H3/t15-,18-,19+,20-,21+,23+,24-,25+/m0/s1
InChIKey: GULIPKAZXQFEMZ-SKVMYEKZSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phlegmariurus squarrosus | Phlegmariurus | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 427.54100000000017
TPSA？: 82.53
MolLogP？: 2.6493000000000007
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bos taurus | Acetylcholinesterase | Inhibition | 50.0 | % | 10.1021/acs.jnatprod.9b00815 |