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1-(11E-octadecenoyl)-2-hexacosanoyl-3-(11Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM192440 Image of MNXM192440
referenceslm:000256117
formulaC65H122O6
global charge0
mol weight999.685
InChIKeyBOKXVUPGCIHVLS-XSSYNYRZSA-N
InChIInChI=1S/C65H122O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-38-41-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-42-39-36-26-23-20-17-14-11-8-5-2)61-70-64(67)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h20-21,23-24,62H,4-19,22,25-61H2,1-3H3/b23-20-,24-21+/t62-/m0/s1
SMILESCCCCCC/C=C\CCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H122O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-38-41-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-42-39-36-26-23-20-17-14-11-8-5-2)61-70-64(67)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h20-21,23-24,62H,4-19,22,25-61H2,1-3H3/b23-20-,24-21+/t62-/m0/s1 Image of MNXM192440
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:65](=[O:68])[O:71][C@@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66])[CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:27]/[CH:24]=[CH:21]/[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67]
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:000256117
slm:000256117
BOKXVUPGCIHVLS-XSSYNYRZSA-N
1-(11E-octadecenoyl)-2-hexacosanoyl-3-(11Z-octadecenoyl)-sn-glycerol
TG(18:1(11E)/26:0/18:1(11Z))
Triacylglycerol (18:1(11E)/26:0/18:1(11Z))