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InChIKey | MLHXDLRLDMFNPU-VPSBVNDRSA-N |
InChI | InChI=1S/C61H110O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-34-36-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-37-33-27-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-26-23-20-17-14-11-8-5-2/h16,19,25-28,32-33,58H,4-15,17-18,20-24,29-31,34-57H2,1-3H3/b19-16-,28-25-,32-26-,33-27-/t58-/m0/s1 |
SMILES | CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 0 |
Distinct compatimentalized reactions in models | 0 |
Identifier | Description |
---|---|
slm:000213604 | 1-(13Z,16Z-docosadienoyl)-2-(9Z-octadecenoyl)-3-(9Z-octadecenoyl)-sn-glycerol TG(22:2(13Z,16Z)/18:1(9Z)/18:1(9Z)) Triacylglycerol (22:2(13Z,16Z)/18:1(9Z)/18:1(9Z)) |
hmdb:HMDB49911 | secondary/obsolete/fantasy identifier |
hmdb:HMDB0049911 | TG(18:1(9Z)/18:1(9Z)/22:2(13Z,16Z)) (2R)-2,3-bis[(9Z)-octadec-9-enoyloxy]propyl (13Z,16Z)-docosa-13,16-dienoate 1-(9Z-Octadecenoyl)-2-(9Z-octadecenoyl)-3-(13Z,16Z-docosadienoyl)-glycerol 1-Oleoyl-2-oleoyl-3-docosadienoyl-glycerol TAG(18:1/18:1/22:2) TAG(58:4) TG(18:1/18:1/22:2) TG(58:4) Tracylglycerol(18:1/18:1/22:2) Tracylglycerol(58:4) Triacylglycerol Triglyceride |
MNXM220386 | is deprecated and replaced by this entry |