General Information of the Compound
| Compound ID |
CP0388860
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[(Z)-octadec-9-enoxy]propoxy]phosphoryl]oxypropanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H48NO8P
|
||||||||||||||||||
| Molecular Weight |
509.621
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCCOC[C@@H](O)COP(O)(=O)OC[C@H](N)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H48NO8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-19-22(26)20-32-34(29,30)33-21-23(25)24(27)28/h9-10,22-23,26H,2-8,11-21,25H2,1H3,(H,27,28)(H,29,30)/b10-9-/t22-,23+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CYQYYSHPNYBPLP-UHAUOVHRSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06255, Probable G-protein coupled receptor 174
Protein ID: PT06254, Probable G-protein coupled receptor 34