In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20049ABO |
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Common Name | PS(10:0/4:1(3E)) |
Systematic Name | 1-decanoyl-2-3E-butenoyl-sn-glycero-3-phosphoserine |
Synonyms | PS(14:1); PS(10:0/4:1) |
Exact Mass | |
Formula | C20H36NO10P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoserines [GP2004] |
PubChem Compound ID (CID) | - |
InChIKey | OBZCEEWLJCXENY-SJORKVTESA-N |
InChI | InChI=1S/C20H36NO10P/c1-3-5-6-7-8-9-10-12-18(22)28-13-16(31-19(23)11-4-2)14-29-3 2(26,27)30-15-17(21)20(24)25/h4,16-17H,2-3,5-15,21H2,1H3,(H,24,25)(H,26,27)/t16- ,17+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CC=C)=O)COC(CCCCCCCCC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |