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1-(11-methyldodecanoyl)-2-triacontanoyl-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM189238 Image of MNXM189238
referenceslm:000260644
formulaC66H118O6
global charge0
mol weight1007.664
InChIKeyYVXHGXNZSNZOCK-QTDDIMKISA-N
InChIInChI=1S/C66H118O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-46-51-55-59-66(69)72-63(61-71-65(68)58-54-50-47-43-44-48-52-56-62(3)4)60-70-64(67)57-53-49-45-41-39-37-35-33-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,35,37,41,45,62-63H,5-7,9,11-13,15,17-19,21,23-34,36,38-40,42-44,46-61H2,1-4H3/b10-8-,16-14-,22-20-,37-35-,45-41-/t63-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C66H118O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-46-51-55-59-66(69)72-63(61-71-65(68)58-54-50-47-43-44-48-52-56-62(3)4)60-70-64(67)57-53-49-45-41-39-37-35-33-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,35,37,41,45,62-63H,5-7,9,11-13,15,17-19,21,23-34,36,38-40,42-44,46-61H2,1-4H3/b10-8-,16-14-,22-20-,37-35-,45-41-/t63-/m0/s1 Image of MNXM189238
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:46][CH2:51][CH2:55][CH2:59][C:66](=[O:69])[O:72][C@@H:63]([CH2:60][O:70][C:64]([CH2:57][CH2:53][CH2:49]/[CH:45]=[CH:41]\[CH2:39]/[CH:37]=[CH:35]\[CH2:33]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])=[O:67])[CH2:61][O:71][C:65]([CH2:58][CH2:54][CH2:50][CH2:47][CH2:43][CH2:44][CH2:48][CH2:52][CH2:56][CH:62]([CH3:3])[CH3:4])=[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:000260644
slm:000260644
YVXHGXNZSNZOCK-QTDDIMKISA-N
1-(11-methyldodecanoyl)-2-triacontanoyl-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol
TG(13:0/30:0/20:5(5Z,8Z,11Z,14Z,17Z))
Triacylglycerol (13:0/30:0/20:5(5Z,8Z,11Z,14Z,17Z))