In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20079ABW |
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Common Name | PA(10:0/7:1(5E)(4OH,7OH,7Ke)) |
Systematic Name | 1-decanoyl-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(17:1(OH2,Ke)); PA(10:0/7:1(OH2,Ke)) |
Exact Mass | |
Formula | C20H35O11P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphates [GP2007] |
PubChem Compound ID (CID) | - |
InChIKey | CXQAMGZMYJOPMP-MIEXTQJLSA-N |
InChI | InChI=1S/C20H35O11P/c1-2-3-4-5-6-7-8-9-19(24)29-14-17(15-30-32(26,27)28)31-20(25 )13-11-16(21)10-12-18(22)23/h10,12,16-17,21H,2-9,11,13-15H2,1H3,(H,22,23)(H2,26, 27,28)/b12-10+/t16?,17-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC(O)/C=C/C(=O)O)=O)COC(CCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |