In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20049AK4 |
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Common Name | PS(14:1(9Z)/4:1(3E)) |
Systematic Name | 1-(9Z-tetradecenoyl)-2-3E-butenoyl-sn-glycero-3-phosphoserine |
Synonyms | PS(18:2); PS(14:1/4:1) |
Exact Mass | |
Formula | C24H42NO10P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoserines [GP2004] |
PubChem Compound ID (CID) | - |
InChIKey | PCDIMSHUGRUYIB-BIDPKSRWSA-N |
InChI | InChI=1S/C24H42NO10P/c1-3-5-6-7-8-9-10-11-12-13-14-16-22(26)32-17-20(35-23(27)15 -4-2)18-33-36(30,31)34-19-21(25)24(28)29/h4,7-8,20-21H,2-3,5-6,9-19,25H2,1H3,(H, 28,29)(H,30,31)/b8-7-/t20-,21+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CC=C)=O)COC(CCCCCCC/C=C\CCCC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |