In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20069AB3 |
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Common Name | PG(10:0/9:0(9Ke)) |
Systematic Name | 1-decanoyl-2-(9-oxo-nonanoyl)-sn-glycero-3-phospho-(1'-sn-glycerol) |
Synonyms | PG(19:0(Ke)); PG(10:0/9:0(Ke)) |
Exact Mass | |
Formula | C25H47O11P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoglycerols [GP2006] |
PubChem Compound ID (CID) | - |
InChIKey | XZSBGZRHICDWHK-XZOQPEGZSA-N |
InChI | InChI=1S/C25H47O11P/c1-2-3-4-5-6-9-12-15-24(29)33-20-23(21-35-37(31,32)34-19-22( 28)18-27)36-25(30)16-13-10-7-8-11-14-17-26/h17,22-23,27-28H,2-16,18-21H2,1H3,(H, 31,32)/t22-,23+/m0/s1 |
SMILES | [H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCCCCCC=O)=O)COC(CCCCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |