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1-(13-methyltetradecanoyl)-2-(11Z-eicosenoyl)-3-heneicosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM212450 Image of MNXM212450
referenceslm:000196787
formulaC59H112O6
global charge0
mol weight917.539
InChIKeyFTGMCOUUPNDGDR-QNMBNHLZSA-N
InChIInChI=1S/C59H112O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-30-34-38-42-46-50-57(60)63-53-56(54-64-58(61)51-47-43-39-36-32-33-37-41-45-49-55(3)4)65-59(62)52-48-44-40-35-31-29-27-24-22-20-18-16-14-12-10-8-6-2/h20,22,55-56H,5-19,21,23-54H2,1-4H3/b22-20-/t56-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C59H112O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-30-34-38-42-46-50-57(60)63-53-56(54-64-58(61)51-47-43-39-36-32-33-37-41-45-49-55(3)4)65-59(62)52-48-44-40-35-31-29-27-24-22-20-18-16-14-12-10-8-6-2/h20,22,55-56H,5-19,21,23-54H2,1-4H3/b22-20-/t56-/m0/s1 Image of MNXM212450
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:26][CH2:28][CH2:30][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][C:57](=[O:60])[O:63][CH2:53][C@@H:56]([CH2:54][O:64][C:58]([CH2:51][CH2:47][CH2:43][CH2:39][CH2:36][CH2:32][CH2:33][CH2:37][CH2:41][CH2:45][CH2:49][CH:55]([CH3:3])[CH3:4])=[O:61])[O:65][C:59]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:35][CH2:31][CH2:29][CH2:27][CH2:24]/[CH:22]=[CH:20]\[CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:62]
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:000196787
slm:000196787
FTGMCOUUPNDGDR-QNMBNHLZSA-N
1-(13-methyltetradecanoyl)-2-(11Z-eicosenoyl)-3-heneicosanoyl-sn-glycerol
TG(15:0/20:1(11Z)/21:0)
Triacylglycerol (15:0/20:1(11Z)/21:0)