In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20049AAA |
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Common Name | PS(10:0/11:1(9E)(11Ke)) |
Systematic Name | 1-decanoyl-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(21:1(Ke)); PS(10:0/11:1(Ke)) |
Exact Mass | |
Formula | C27H48NO11P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoserines [GP2004] |
PubChem Compound ID (CID) | - |
InChIKey | TVJVFKXINFTIHK-PEEOZJOBSA-N |
InChI | InChI=1S/C27H48NO11P/c1-2-3-4-5-8-11-14-17-25(30)36-20-23(21-37-40(34,35)38-22-2 4(28)27(32)33)39-26(31)18-15-12-9-6-7-10-13-16-19-29/h13,16,19,23-24H,2-12,14-15 ,17-18,20-22,28H2,1H3,(H,32,33)(H,34,35)/b16-13+/t23-,24+/m1/s1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC/C=C/C=O)=O)COC(CCCCCCCCC)=O)(=O) O |
MS Spectra | - |
Status | Active (generated by computational methods) |