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1,3-di-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-tridecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM177965 Image of MNXM177965
referenceslm:000193450
formulaC60H96O6
global charge0
mol weight913.422
InChIKeyDETNVLIQAPNKRE-GGNITGIQSA-N
InChIInChI=1S/C60H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-41-43-46-49-52-58(61)64-55-57(66-60(63)54-51-48-45-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-42-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-27,30-33,36-39,43-44,46-47,57H,4-15,18,21-23,28-29,34-35,40-42,45,48-56H2,1-3H3/b19-16-,20-17-,26-24-,27-25-,32-30-,33-31-,38-36-,39-37-,46-43-,47-44-
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OCC(COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-41-43-46-49-52-58(61)64-55-57(66-60(63)54-51-48-45-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-42-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-27,30-33,36-39,43-44,46-47,57H,4-15,18,21-23,28-29,34-35,40-42,45,48-56H2,1-3H3/b19-16-,20-17-,26-24-,27-25-,32-30-,33-31-,38-36-,39-37-,46-43-,47-44- Image of MNXM177965
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34]/[CH:36]=[CH:38]\[CH2:41]/[CH:43]=[CH:46]\[CH2:49][CH2:52][C:58](=[O:61])[O:64][CH2:55][CH:57]([CH2:56][O:65][C:59]([CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:42]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:40][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:63]
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:000193450
slm:000193450
DETNVLIQAPNKRE-GGNITGIQSA-N
1,3-di-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-tridecanoyl-sn-glycerol
TG(22:5(4Z,7Z,10Z,13Z,16Z)/13:0/22:5(4Z,7Z,10Z,13Z,16Z))
Triacylglycerol (22:5(4Z,7Z,10Z,13Z,16Z)/13:0/22:5(4Z,7Z,10Z,13Z,16Z))