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1-docosanoyl-2-(9Z,11E-octadecadienoyl)-3-(11Z,14Z,17Z-eicoastrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM347930 Image of MNXM347930
referenceslm:000233557
formulaC63H112O6
global charge0
mol weight965.583
InChIKeyTZPVTWNLEWZGBD-LVPJBHLKSA-N
InChIInChI=1S/C63H112O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-38-41-44-47-50-53-56-62(65)68-59-60(69-63(66)57-54-51-48-45-42-39-34-27-24-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26-27,29,34,60H,4-7,9-10,12-16,18-19,22-23,25,28,30-33,35-59H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,34-27-/t60-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C63H112O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-38-41-44-47-50-53-56-62(65)68-59-60(69-63(66)57-54-51-48-45-42-39-34-27-24-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26-27,29,34,60H,4-7,9-10,12-16,18-19,22-23,25,28,30-33,35-59H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,34-27-/t60-/m0/s1 Image of MNXM347930
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:31][CH2:33][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39]/[CH:34]=[CH:27]\[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:66]
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:000233557
slm:000233557
TZPVTWNLEWZGBD-LVPJBHLKSA-N
1-docosanoyl-2-(9Z,11E-octadecadienoyl)-3-(11Z,14Z,17Z-eicoastrienoyl)-sn-glycerol
TG(22:0/18:2(9Z,11E)/20:3(11Z,14Z,17Z))
Triacylglycerol (22:0/18:2(9Z,11E)/20:3(11Z,14Z,17Z))