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1-(15-methylhexadecanoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-(9Z,12Z-hexadecadienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM228582 Image of MNXM228582
referenceslm:000178042
formulaC58H98O6
global charge0
mol weight891.416
InChIKeyULSDZOGWYDFPMK-QBSYFLQVSA-N
InChIInChI=1S/C58H98O6/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-30-35-39-43-47-51-58(61)64-55(52-62-56(59)49-45-41-37-33-29-25-18-16-14-12-10-8-6-2)53-63-57(60)50-46-42-38-34-31-27-28-32-36-40-44-48-54(3)4/h10,12-13,15-16,18-20,22-23,26,30,39,43,54-55H,5-9,11,14,17,21,24-25,27-29,31-38,40-42,44-53H2,1-4H3/b12-10-,15-13-,18-16-,20-19-,23-22-,30-26-,43-39-/t55-/m0/s1
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C58H98O6/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-30-35-39-43-47-51-58(61)64-55(52-62-56(59)49-45-41-37-33-29-25-18-16-14-12-10-8-6-2)53-63-57(60)50-46-42-38-34-31-27-28-32-36-40-44-48-54(3)4/h10,12-13,15-16,18-20,22-23,26,30,39,43,54-55H,5-9,11,14,17,21,24-25,27-29,31-38,40-42,44-53H2,1-4H3/b12-10-,15-13-,18-16-,20-19-,23-22-,30-26-,43-39-/t55-/m0/s1 Image of MNXM228582
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:26]=[CH:30]\[CH2:35]/[CH:39]=[CH:43]\[CH2:47][CH2:51][C:58](=[O:61])[O:64][C@@H:55]([CH2:52][O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:29][CH2:25]/[CH:18]=[CH:16]\[CH2:14]/[CH:12]=[CH:10]\[CH2:8][CH2:6][CH3:2])=[O:59])[CH2:53][O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:31][CH2:27][CH2:28][CH2:32][CH2:36][CH2:40][CH2:44][CH2:48][CH:54]([CH3:3])[CH3:4])=[O:60]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000178042
slm:000178042
ULSDZOGWYDFPMK-QBSYFLQVSA-N
1-(15-methylhexadecanoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-(9Z,12Z-hexadecadienoyl)-sn-glycerol
TG(17:0/22:5(4Z,7Z,10Z,13Z,16Z)/16:2(9Z,12Z))
Triacylglycerol (17:0/22:5(4Z,7Z,10Z,13Z,16Z)/16:2(9Z,12Z))