In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20069AB4 |
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Common Name | PG(10:0/9:0(9OH,9Ke)) |
Systematic Name | 1-decanoyl-2-azeloyl-sn-glycero-3-phospho-(1'-sn-glycerol) |
Synonyms | PG(19:0(OH,Ke)); PG(10:0/9:0(OH,Ke)) |
Exact Mass | |
Formula | C25H47O12P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoglycerols [GP2006] |
PubChem Compound ID (CID) | - |
InChIKey | IIIPCJZBFLCPNQ-FCHUYYIVSA-N |
InChI | InChI=1S/C25H47O12P/c1-2-3-4-5-6-9-12-15-24(30)34-19-22(20-36-38(32,33)35-18-21( 27)17-26)37-25(31)16-13-10-7-8-11-14-23(28)29/h21-22,26-27H,2-20H2,1H3,(H,28,29) (H,32,33)/t21-,22+/m0/s1 |
SMILES | [H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCCCCCC(=O)O)=O)COC(CCCCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |