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1-(13-methyltetradecanoyl)-2-octadecanoyl-3-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM215319 Image of MNXM215319
referenceslm:000201212
formulaC60H106O6
global charge0
mol weight923.502
InChIKeyNMTOWAJNSZRYML-LNOOZMJBSA-N
InChIInChI=1S/C60H106O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-29-31-35-39-43-47-51-58(61)64-54-57(55-65-59(62)52-48-44-40-37-33-34-38-42-46-50-56(3)4)66-60(63)53-49-45-41-36-32-30-27-20-18-16-14-12-10-8-6-2/h7,9,13,15,19,21,23-24,26,28,56-57H,5-6,8,10-12,14,16-18,20,22,25,27,29-55H2,1-4H3/b9-7-,15-13-,21-19-,24-23-,28-26-/t57-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H106O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-29-31-35-39-43-47-51-58(61)64-54-57(55-65-59(62)52-48-44-40-37-33-34-38-42-46-50-56(3)4)66-60(63)53-49-45-41-36-32-30-27-20-18-16-14-12-10-8-6-2/h7,9,13,15,19,21,23-24,26,28,56-57H,5-6,8,10-12,14,16-18,20,22,25,27,29-55H2,1-4H3/b9-7-,15-13-,21-19-,24-23-,28-26-/t57-/m0/s1 Image of MNXM215319
SMILES (mnx)[CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:28]\[CH2:29][CH2:31][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][C:58](=[O:61])[O:64][CH2:54][C@@H:57]([CH2:55][O:65][C:59]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:37][CH2:33][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][CH:56]([CH3:3])[CH3:4])=[O:62])[O:66][C:60]([CH2:53][CH2:49][CH2:45][CH2:41][CH2:36][CH2:32][CH2:30][CH2:27][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[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:000201212
slm:000201212
NMTOWAJNSZRYML-LNOOZMJBSA-N
1-(13-methyltetradecanoyl)-2-octadecanoyl-3-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycerol
TG(15:0/18:0/24:5(9Z,12Z,15Z,18Z,21Z))
Triacylglycerol (15:0/18:0/24:5(9Z,12Z,15Z,18Z,21Z))