In-Silico Structure database (LMISSD)
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LM ID | LMGP03019ABN |
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Common Name | PS(10:0/20:4(7E,10E,13E,16E)) |
Systematic Name | 1-decanoyl-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(30:4); PS(10:0_20:4) |
Exact Mass | |
Formula | C36H62NO10P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | Diacylglycerophosphoserines [GP0301] |
PubChem Compound ID (CID) | - |
InChIKey | JTESPLOVVBZSGS-CKXHIGEMSA-N |
InChI | InChI=1S/C36H62NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-35(39) 47-32(30-45-48(42,43)46-31-33(37)36(40)41)29-44-34(38)27-25-23-21-10-8-6-4-2/h7, 9,12-13,15-16,18-19,32-33H,3-6,8,10-11,14,17,20-31,37H2,1-2H3,(H,40,41)(H,42,43) /b9-7+,13-12+,16-15+,19-18+/t32-,33+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)COC(C CCCCCCCC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |