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1-docosanoyl-2-(9Z-octadecenoyl)-3-eicosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM138369 Image of MNXM138369
referenceslm:000238733
formulaC63H120O6
global charge0
mol weight973.647
InChIKeyGTQFAXDJIANZMD-JWYLQQGLSA-N
InChIInChI=1S/C63H120O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-38-41-44-47-50-53-56-62(65)68-59-60(69-63(66)57-54-51-48-45-42-39-34-27-24-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h27,34,60H,4-26,28-33,35-59H2,1-3H3/b34-27-/t60-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C63H120O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-38-41-44-47-50-53-56-62(65)68-59-60(69-63(66)57-54-51-48-45-42-39-34-27-24-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h27,34,60H,4-26,28-33,35-59H2,1-3H3/b34-27-/t60-/m0/s1 Image of MNXM138369
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:31][CH2:33][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@H:60]([CH2:58][O:67][C:61]([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:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39]/[CH:34]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:66]
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:000238733
slm:000238733
GTQFAXDJIANZMD-JWYLQQGLSA-N
1-docosanoyl-2-(9Z-octadecenoyl)-3-eicosanoyl-sn-glycerol
TG(22:0/18:1(9Z)/20:0)
Triacylglycerol (22:0/18:1(9Z)/20:0)
hmdb:HMDB0045738
GTQFAXDJIANZMD-JWYLQQGLSA-N
TG(20:0/18:1(9Z)/22:0)
(2S)-3-(icosanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl docosanoate
1-Arachidonyl-2-oleoyl-3-behenoyl-glycerol
1-Eicosanoyl-2-(9Z-octadecenoyl)-3-docosanoyl-glycerol
TAG(20:0/18:1/22:0)
TAG(60:1)
TG(20:0/18:1/22:0)
TG(60:1)
Tracylglycerol(20:0/18:1/22:0)
Tracylglycerol(60:1)
Triacylglycerol
Triglyceride

hmdb:HMDB45738
secondary/obsolete/fantasy identifier