In-Silico Structure database (LMISSD)
| |
LM ID | LMGP01019AAN |
---|---|
Common Name | PC(10:0/17:2(9Z,12Z)) |
Systematic Name | 1-decanoyl-2-(9Z,12Z-heptadecadienoyl)-sn-glycero-3-phosphocholine |
Synonyms | PC(27:2); PC(10:0_17:2) |
Exact Mass | |
Formula | C35H66NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphocholines [GP01] |
Sub Class | Diacylglycerophosphocholines [GP0101] |
PubChem Compound ID (CID) | - |
InChIKey | MNLXSOGVFNFMKS-LGBCIWHMSA-N |
InChI | InChI=1S/C35H66NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-22-24-26-28-35(38)44-33(32 -43-45(39,40)42-30-29-36(3,4)5)31-41-34(37)27-25-23-21-13-11-9-7-2/h12,14,16-17, 33H,6-11,13,15,18-32H2,1-5H3/b14-12-,17-16-/t33-/m1/s1 |
SMILES | [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCC C)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |