In-Silico Structure database (LMISSD)
| |
LM ID | LMGP06019AAJ |
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Common Name | PI(10:0/16:1(7Z)) |
Systematic Name | 1-decanoyl-2-(7Z-hexadecenoyl)-sn-glycero-3-phosphoinositol |
Synonyms | PI(26:1); PI(10:0_16:1) |
Exact Mass | |
Formula | C35H65O13P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositols [GP06] |
Sub Class | Diacylglycerophosphoinositols [GP0601] |
PubChem Compound ID (CID) | - |
InChIKey | ADBGWXISIKHHIF-KZMDVBAGSA-N |
InChI | InChI=1S/C35H65O13P/c1-3-5-7-9-11-12-13-14-15-16-18-20-22-24-29(37)47-27(25-45-2 8(36)23-21-19-17-10-8-6-4-2)26-46-49(43,44)48-35-33(41)31(39)30(38)32(40)34(35)4 2/h14-15,27,30-35,38-42H,3-13,16-26H2,1-2H3,(H,43,44)/b15-14-/t27-,30?,31-,32?,3 3?,34?,35-/m1/s1 |
SMILES | [C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)CO C(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |