(2-{[(2R)-3-(heptadecyloxy)-2-hydroxypropyl phosphonato]oxy}ethyl)trimethylazanium
AlkaPlorer ID: AK402885
Synonym: None
IUPAC Name: [(2R)-3-heptadecoxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Structure
SMILES: CCCCCCCCCCCCCCCCCOC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChI: InChI=1S/C25H54NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-30-23-25(27)24-32-33(28,29)31-22-20-26(2,3)4/h25,27H,5-24H2,1-4H3/t25-/m1/s1
InChIKey: HQRBTQCLRRUGMR-RUZDIDTESA-N
Reference
Inhibitors of Osteoclast Differentiation from <i>Cephalotaxus koreana</i>
PubChem CID: 10413466
SuperNatural Ⅲ: SN0132813-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 495.6820000000002
TPSA？: 88.05
MolLogP？: 5.443100000000005
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Autotaxin | Activity | 49.0 | % | 10.1016/j.bmc.2009.03.030 |
| Homo sapiens | Autotaxin | Activity | 89.0 | % | 10.1016/j.bmc.2009.03.030 |
| Homo sapiens | Autotaxin | Activity | 100.0 | % | 10.1016/j.bmc.2009.03.030 |