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1-(11Z-eicosenoyl)-2-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-3-tridecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM204675 Image of MNXM204675
referenceslm:000199452
formulaC60H104O6
global charge0
mol weight921.486
InChIKeyIJXNUZRZLPNZSJ-QYFIBFTNSA-N
InChIInChI=1S/C60H104O6/c1-4-7-10-13-16-19-22-24-26-28-29-30-31-33-35-37-39-42-45-48-51-54-60(63)66-57(55-64-58(61)52-49-46-43-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-34-32-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,29-30,33,35,57H,4-6,8-9,11-15,17-18,20-23,28,31-32,34,36-56H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,30-29-,35-33-/t57-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H104O6/c1-4-7-10-13-16-19-22-24-26-28-29-30-31-33-35-37-39-42-45-48-51-54-60(63)66-57(55-64-58(61)52-49-46-43-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-34-32-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,29-30,33,35,57H,4-6,8-9,11-15,17-18,20-23,28,31-32,34,36-56H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,30-29-,35-33-/t57-/m0/s1 Image of MNXM204675
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][C:60](=[O:63])[O:66][C@@H:57]([CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61])[CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:36][CH2:34][CH2:32]/[CH:27]=[CH:25]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62]
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:000199452
slm:000199452
IJXNUZRZLPNZSJ-QYFIBFTNSA-N
1-(11Z-eicosenoyl)-2-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-3-tridecanoyl-sn-glycerol
TG(20:1(11Z)/24:5(9Z,12Z,15Z,18Z,21Z)/13:0)
Triacylglycerol (20:1(11Z)/24:5(9Z,12Z,15Z,18Z,21Z)/13:0)