In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08019AA4 |
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Common Name | PIP2[3',4'](10:0/18:3(6Z,9Z,12Z)) |
Systematic Name | 1-decanoyl-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphoinositol-3,4- bisphosphate |
Synonyms | PIP2[3',4'](28:3); PIP2(10:0_18:3) |
Exact Mass | |
Formula | C37H67O19P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Diacylglycerophosphoinositol bisphosphates [GP0801] |
PubChem Compound ID (CID) | - |
InChIKey | HGJZPVCUVURWKB-HLSKRUHISA-N |
InChI | InChI=1S/C37H67O19P3/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-31(39)53-29( 27-51-30(38)25-23-21-19-10-8-6-4-2)28-52-59(49,50)56-35-32(40)33(41)36(54-57(43, 44)45)37(34(35)42)55-58(46,47)48/h11-12,14-15,17-18,29,32-37,40-42H,3-10,13,16,1 9-28H2,1-2H3,(H,49,50)(H2,43,44,45)(H2,46,47,48)/b12-11-,15-14-,18-17-/t29-,32?, 33?,34?,35+,36?,37+/m1/s1 |
SMILES | [C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O )O)C(OP(=O)(O)O)C(O)C1O)COC(CCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |