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1,3-diheneicosanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM178835 Image of MNXM178835
referenceslm:000254798
formulaC65H120O6
global charge0
mol weight997.669
InChIKeyKKDNVXWUGMCAOB-QFXJXGHKSA-N
InChIInChI=1S/C65H120O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-39-42-45-48-51-54-57-63(66)69-60-62(71-65(68)59-56-53-50-47-44-41-38-33-30-27-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h18,21,27,30,38,41,62H,4-17,19-20,22-26,28-29,31-37,39-40,42-61H2,1-3H3/b21-18-,30-27-,41-38-
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H120O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-39-42-45-48-51-54-57-63(66)69-60-62(71-65(68)59-56-53-50-47-44-41-38-33-30-27-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h18,21,27,30,38,41,62H,4-17,19-20,22-26,28-29,31-37,39-40,42-61H2,1-3H3/b21-18-,30-27-,41-38- Image of MNXM178835
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:34][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][CH2:60][CH:62]([CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:35][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:67])[O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44]/[CH:41]=[CH:38]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:68]
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:000254798
slm:000254798
KKDNVXWUGMCAOB-QFXJXGHKSA-N
1,3-diheneicosanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol
TG(21:0/20:3(8Z,11Z,14Z)/21:0)
Triacylglycerol (21:0/20:3(8Z,11Z,14Z)/21:0)