In-Silico Structure database (LMISSD)
| |
LM ID | LMGP06029AXC |
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Common Name | PI(O-20:1(9Z)/10:0) |
Systematic Name | 1-(9Z-eicosenyl)-2-decanoyl-sn-glycero-3-phosphoinositol |
Synonyms | PI(O-30:1); PI(O-20:1/10:0) |
Exact Mass | |
Formula | C39H75O12P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositols [GP06] |
Sub Class | 1-alkyl,2-acylglycerophosphoinositols [GP0602] |
PubChem Compound ID (CID) | - |
InChIKey | VLXJXLQIGCTUSR-LZQBGOFASA-N |
InChI | InChI=1S/C39H75O12P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-27-29-48-3 0-32(50-33(40)28-26-24-22-10-8-6-4-2)31-49-52(46,47)51-39-37(44)35(42)34(41)36(4 3)38(39)45/h16-17,32,34-39,41-45H,3-15,18-31H2,1-2H3,(H,46,47)/b17-16-/t32-,34?, 35-,36?,37?,38?,39-/m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COCCCCCCCC/ C=C\CCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |