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1-(11E-octadecenoyl)-2-triacontanoyl-3-(9Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM193023 Image of MNXM193023
referenceslm:000283752
formulaC69H130O6
global charge0
mol weight1055.793
InChIKeyZFJAKFGEPPQSJA-HMKRAESRSA-N
InChIInChI=1S/C69H130O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-42-45-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-46-43-40-26-23-20-17-14-11-8-5-2)65-74-68(71)62-59-56-53-50-47-44-41-27-24-21-18-15-12-9-6-3/h20,23,27,41,66H,4-19,21-22,24-26,28-40,42-65H2,1-3H3/b23-20+,41-27-/t66-/m1/s1
SMILESCCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C69H130O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-38-39-42-45-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-46-43-40-26-23-20-17-14-11-8-5-2)65-74-68(71)62-59-56-53-50-47-44-41-27-24-21-18-15-12-9-6-3/h20,23,27,41,66H,4-19,21-22,24-26,28-40,42-65H2,1-3H3/b23-20+,41-27-/t66-/m1/s1 Image of MNXM193023
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][CH2:36][CH2:37][CH2:38][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:69](=[O:72])[O:75][C@H:66]([CH2:64][O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:26]/[CH:23]=[CH:20]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:70])[CH2:65][O:74][C:68]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44]/[CH:41]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:71]
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:000283752
slm:000283752
ZFJAKFGEPPQSJA-HMKRAESRSA-N
1-(11E-octadecenoyl)-2-triacontanoyl-3-(9Z-octadecenoyl)-sn-glycerol
TG(18:1(11E)/30:0/18:1(9Z))
Triacylglycerol (18:1(11E)/30:0/18:1(9Z))