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1-(13Z-docosenoyl)-2-(13-methyltetradecanoyl)-3-nonadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM222018 Image of MNXM222018
referenceslm:000196775
formulaC59H112O6
global charge0
mol weight917.539
InChIKeyHDVWJWDLVBMCKW-MEANZNRESA-N
InChIInChI=1S/C59H112O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-27-29-31-35-39-43-47-51-58(61)64-54-56(65-59(62)52-48-44-40-36-32-33-37-41-45-49-55(3)4)53-63-57(60)50-46-42-38-34-30-28-26-22-20-18-16-14-12-10-8-6-2/h19,21,55-56H,5-18,20,22-54H2,1-4H3/b21-19-/t56-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C59H112O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-27-29-31-35-39-43-47-51-58(61)64-54-56(65-59(62)52-48-44-40-36-32-33-37-41-45-49-55(3)4)53-63-57(60)50-46-42-38-34-30-28-26-22-20-18-16-14-12-10-8-6-2/h19,21,55-56H,5-18,20,22-54H2,1-4H3/b21-19-/t56-/m0/s1 Image of MNXM222018
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17]/[CH:19]=[CH:21]\[CH2:23][CH2:24][CH2:25][CH2:27][CH2:29][CH2:31][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][C:58](=[O:61])[O:64][CH2:54][C@H:56]([CH2:53][O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:30][CH2:28][CH2:26][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:60])[O:65][C:59]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:32][CH2:33][CH2:37][CH2:41][CH2:45][CH2:49][CH:55]([CH3:3])[CH3:4])=[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:000196775
slm:000196775
HDVWJWDLVBMCKW-MEANZNRESA-N
1-(13Z-docosenoyl)-2-(13-methyltetradecanoyl)-3-nonadecanoyl-sn-glycerol
TG(22:1(13Z)/15:0/19:0)
Triacylglycerol (22:1(13Z)/15:0/19:0)