In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08049AAN |
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Common Name | LPIP2[3',4'](17:2(9Z,12Z)/0:0) |
Systematic Name | 1-(9Z,12Z-heptadecadienoyl)-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | - |
Exact Mass | |
Formula | C26H49O18P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Monoacylglycerophosphoinositol bisphosphates [GP0804] |
PubChem Compound ID (CID) | - |
InChIKey | QPFVTYOXXTWHPK-ABNIEULSSA-N |
InChI | InChI=1S/C26H49O18P3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(28)40-17-19(27)1 8-41-47(38,39)44-24-21(29)22(30)25(42-45(32,33)34)26(23(24)31)43-46(35,36)37/h5- 6,8-9,19,21-27,29-31H,2-4,7,10-18H2,1H3,(H,38,39)(H2,32,33,34)(H2,35,36,37)/b6-5 -,9-8-/t19-,21?,22?,23?,24+,25?,26+/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 CCCC/C=CC/C=CCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |