In-Silico Structure database (LMISSD)
| |
LM ID | LMGP06039DDH |
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Common Name | PI(P-14:0/12:0) |
Systematic Name | 1-(1Z-tetradecenyl)-2-dodecanoyl-sn-glycero-3-phosphoinositol |
Synonyms | PI(P-26:0); PI(P-14:0/12:0) |
Exact Mass | |
Formula | C35H67O12P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositols [GP06] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoinositols [GP0603] |
PubChem Compound ID (CID) | - |
InChIKey | XIPKUZQLJMVYDJ-HDIDRFFMSA-N |
InChI | InChI=1S/C35H67O12P/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-44-26-28(46-29(36)24-2 2-20-18-16-12-10-8-6-4-2)27-45-48(42,43)47-35-33(40)31(38)30(37)32(39)34(35)41/h 23,25,28,30-35,37-41H,3-22,24,26-27H2,1-2H3,(H,42,43)/b25-23-/t28-,30?,31-,32?,3 3?,34?,35-/m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)CO/C=C\CC CCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |