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1-(9Z-tetradecenoyl)-2-(10Z,13Z,16Z-docosatrienoyl)-3-heptadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM335418 Image of MNXM335418
referenceslm:000164078
formulaC56H100O6
global charge0
mol weight869.41
InChIKeyUQUNMLVWCKISRF-LNRJWYPUSA-N
InChIInChI=1S/C56H100O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-32-35-38-41-44-47-50-56(59)62-53(51-60-54(57)48-45-42-39-36-33-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-31-25-23-20-17-14-11-8-5-2/h15-16,18-19,24,26,28-29,53H,4-14,17,20-23,25,27,30-52H2,1-3H3/b18-15-,19-16-,26-24-,29-28-/t53-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCC)OC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C56H100O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-32-35-38-41-44-47-50-56(59)62-53(51-60-54(57)48-45-42-39-36-33-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-31-25-23-20-17-14-11-8-5-2/h15-16,18-19,24,26,28-29,53H,4-14,17,20-23,25,27,30-52H2,1-3H3/b18-15-,19-16-,26-24-,29-28-/t53-/m1/s1 Image of MNXM335418
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][C:56](=[O:59])[O:62][C@H:53]([CH2:51][O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:57])[CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:25][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58]
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:000164078
slm:000164078
UQUNMLVWCKISRF-LNRJWYPUSA-N
1-(9Z-tetradecenoyl)-2-(10Z,13Z,16Z-docosatrienoyl)-3-heptadecanoyl-sn-glycerol
TG(14:1(9Z)/22:3(10Z,13Z,16Z)/17:0)
Triacylglycerol (14:1(9Z)/22:3(10Z,13Z,16Z)/17:0)