In-Silico Structure database (LMISSD)
| |
LM ID | LMGP04029AN4 |
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Common Name | PG(O-18:1(11Z)/10:0) |
Systematic Name | 1-(11Z-octadecenyl)-2-decanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) |
Synonyms | PG(O-28:1); PG(O-18:1/10:0) |
Exact Mass | |
Formula | C34H67O9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerols [GP04] |
Sub Class | 1-alkyl,2-acylglycerophosphoglycerols [GP0402] |
PubChem Compound ID (CID) | - |
InChIKey | KLNNXVBYSGAKGC-PJJBRUTISA-N |
InChI | InChI=1S/C34H67O9P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-27-40-30-33(31 -42-44(38,39)41-29-32(36)28-35)43-34(37)26-24-22-20-10-8-6-4-2/h12-13,32-33,35-3 6H,3-11,14-31H2,1-2H3,(H,38,39)/b13-12-/t32-,33+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCCCC/C=C\CCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |