In-Silico Structure database (LMISSD)
| |
LM ID | LMGP09049ABV |
---|---|
Common Name | LPIP3[3',4',5'](22:5(7Z,10Z,13Z,16Z,19Z)/0:0) |
Systematic Name | 1-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphoinositol-3,4,5- trisphosphate |
Synonyms | - |
Exact Mass | |
Formula | C31H54O21P4 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol trisphosphates [GP09] |
Sub Class | Monoacylglycerophosphoinositol trisphosphates [GP0904] |
PubChem Compound ID (CID) | - |
InChIKey | WGURBKGPZACNFY-FMJQXTHMSA-N |
InChI | InChI=1S/C31H54O21P4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(3 3)47-22-24(32)23-48-56(45,46)52-28-26(34)29(49-53(36,37)38)31(51-55(42,43)44)30( 27(28)35)50-54(39,40)41/h3-4,6-7,9-10,12-13,15-16,24,26-32,34-35H,2,5,8,11,14,17 -23H2,1H3,(H,45,46)(H2,36,37,38)(H2,39,40,41)(H2,42,43,44)/b4-3-,7-6-,10-9-,13-1 2-,16-15-/t24-,26?,27?,28-,29+,30?,31?/m1/s1 |
SMILES | [C@]([H])(O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1 O)COC(CCCCC/C=CC/C=CC/C=CC/C=CC/C=CCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |