In-Silico Structure database (LMISSD)
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LM ID | LMGL02019FRH |
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Common Name | DG(12:0/0:0/20:4(5E,8E,11E,14E)) |
Systematic Name | 1-dodecanoyl-3-(5E,8E,11E,14E-eicosatetraenoyl)-sn-glycerol |
Synonyms | DG(32:4); DG(12:0_20:4) |
Exact Mass | |
Formula | C35H60O5 |
Category | Glycerolipids [GL] |
Main Class | Diradylglycerols [GL02] |
Sub Class | Diacylglycerols [GL0201] |
PubChem Compound ID (CID) | - |
InChIKey | PPZOLUFHGLPRHI-SLMLWSGYSA-N |
InChI | InChI=1S/C35H60O5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-30-35(38)40- 32-33(36)31-39-34(37)29-27-25-23-21-12-10-8-6-4-2/h11,13,15-16,18-19,22,24,33,36 H,3-10,12,14,17,20-21,23,25-32H2,1-2H3/b13-11+,16-15+,19-18+,24-22+/t33-/m1/s1 |
SMILES | C(OC(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)[C@]([H])(O)COC(CCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |