In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08019ALY |
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Common Name | PIP2[3',4'](14:1(9Z)/14:1(9Z)) |
Systematic Name | 1-2-di-(9Z-tetradecenoyl)-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | PIP2[3',4'](28:2); PIP2(14:1/14:1) |
Exact Mass | |
Formula | C37H69O19P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Diacylglycerophosphoinositol bisphosphates [GP0801] |
PubChem Compound ID (CID) | - |
InChIKey | AKDZTXKVNYSHQZ-BFWKXSKCSA-N |
InChI | InChI=1S/C37H69O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-30(38)51-27-29(53-31(39) 26-24-22-20-18-16-14-12-10-8-6-4-2)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/h9-12,29,32-37,40-42H,3-8,13-28H2,1-2H3,(H,49,5 0)(H2,43,44,45)(H2,46,47,48)/b11-9-,12-10-/t29-,32?,33?,34?,35+,36?,37+/m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O )(O)O)C(O)C1O)COC(CCCCCCC/C=C\CCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |