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1-heneicosanoyl-2-(6Z-hexadecenoyl)-3-(6Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM357884 Image of MNXM357884
referenceslm:000185045
formulaC58H108O6
global charge0
mol weight901.496
InChIKeyWEXOVBPEXDNIRK-QSMXRMGZSA-N
InChIInChI=1S/C58H108O6/c1-4-7-10-13-16-19-22-25-27-28-29-31-34-36-39-42-45-48-51-57(60)63-54-55(64-58(61)52-49-46-43-40-37-32-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-33-30-26-23-20-17-14-11-8-5-2/h35,37-38,40,55H,4-34,36,39,41-54H2,1-3H3/b38-35-,40-37-/t55-/m0/s1
SMILESCCCCCCCCC/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCC/C=C\CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C58H108O6/c1-4-7-10-13-16-19-22-25-27-28-29-31-34-36-39-42-45-48-51-57(60)63-54-55(64-58(61)52-49-46-43-40-37-32-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-33-30-26-23-20-17-14-11-8-5-2/h35,37-38,40,55H,4-34,36,39,41-54H2,1-3H3/b38-35-,40-37-/t55-/m0/s1 Image of MNXM357884
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:28][CH2:29][CH2:31][CH2:34][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][C:57](=[O:60])[O:63][CH2:54][C@H:55]([CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41]/[CH:38]=[CH:35]\[CH2:33][CH2:30][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59])[O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43]/[CH:40]=[CH:37]\[CH2:32][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61]
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:000185045
slm:000185045
WEXOVBPEXDNIRK-QSMXRMGZSA-N
1-heneicosanoyl-2-(6Z-hexadecenoyl)-3-(6Z-octadecenoyl)-sn-glycerol
TG(21:0/16:1(6Z)/18:1(6Z))
Triacylglycerol (21:0/16:1(6Z)/18:1(6Z))