In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08049AAD |
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Common Name | LPIP2[3',4'](13:0/0:0) |
Systematic Name | 1-tridecanoyl-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | - |
Exact Mass | |
Formula | C22H45O18P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Monoacylglycerophosphoinositol bisphosphates [GP0804] |
PubChem Compound ID (CID) | - |
InChIKey | JDQRHIDEIBUMHN-FJRBLVNISA-N |
InChI | InChI=1S/C22H45O18P3/c1-2-3-4-5-6-7-8-9-10-11-12-16(24)36-13-15(23)14-37-43(34,3 5)40-20-17(25)18(26)21(38-41(28,29)30)22(19(20)27)39-42(31,32)33/h15,17-23,25-27 H,2-14H2,1H3,(H,34,35)(H2,28,29,30)(H2,31,32,33)/t15-,17?,18?,19?,20+,21?,22+/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(O)C1O)COC(CCC CCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |