In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08019ACO |
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Common Name | PIP2[3',4'](11:0/13:0) |
Systematic Name | 1-undecanoyl-2-tridecanoyl-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | PIP2[3',4'](24:0); PIP2(11:0_13:0) |
Exact Mass | |
Formula | C33H65O19P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Diacylglycerophosphoinositol bisphosphates [GP0801] |
PubChem Compound ID (CID) | - |
InChIKey | HMAYLXKERHINFF-JKCSCHAFSA-N |
InChI | InChI=1S/C33H65O19P3/c1-3-5-7-9-11-13-14-16-18-20-22-27(35)49-25(23-47-26(34)21- 19-17-15-12-10-8-6-4-2)24-48-55(45,46)52-31-28(36)29(37)32(50-53(39,40)41)33(30( 31)38)51-54(42,43)44/h25,28-33,36-38H,3-24H2,1-2H3,(H,45,46)(H2,39,40,41)(H2,42, 43,44)/t25-,28?,29?,30?,31+,32?,33+/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(CCCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |