In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08019AHA |
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Common Name | PIP2[3',4'](13:0/13:0) |
Systematic Name | 1-2-di-tridecanoyl-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | PIP2[3',4'](26:0); PIP2(13:0/13:0) |
Exact Mass | |
Formula | C35H69O19P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Diacylglycerophosphoinositol bisphosphates [GP0801] |
PubChem Compound ID (CID) | - |
InChIKey | GRZRHFOOPOHDAV-CVGAMXHRSA-N |
InChI | InChI=1S/C35H69O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-28(36)49-25-27(51-29(37)24- 22-20-18-16-14-12-10-8-6-4-2)26-50-57(47,48)54-33-30(38)31(39)34(52-55(41,42)43) 35(32(33)40)53-56(44,45)46/h27,30-35,38-40H,3-26H2,1-2H3,(H,47,48)(H2,41,42,43)( H2,44,45,46)/t27-,30?,31?,32?,33+,34?,35+/m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O) O)C(O)C1O)COC(CCCCCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |