In-Silico Structure database (LMISSD)
| |
LM ID | LMGP06059AA4 |
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Common Name | LPI(18:3(6Z,9Z,12Z)/0:0) |
Systematic Name | 1-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphoinositol |
Synonyms | - |
Exact Mass | |
Formula | C27H47O12P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositols [GP06] |
Sub Class | Monoacylglycerophosphoinositols [GP0605] |
PubChem Compound ID (CID) | - |
InChIKey | LLHYFNVRZDNGJG-CPGAUMDZSA-N |
InChI | InChI=1S/C27H47O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)37-18-20(28 )19-38-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h6-7,9-10,12-13,20,22-28, 30-34H,2-5,8,11,14-19H2,1H3,(H,35,36)/b7-6-,10-9-,13-12-/t20-,22?,23-,24?,25?,26 ?,27-/m1/s1 |
SMILES | [C@]([H])(O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COC(CCCC/C=CC/C=CC/C=CCCC CC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |