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1-(10Z,13Z,16Z-docosatrienoyl)-2-octacosanoyl-3-dodecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM185137 Image of MNXM185137
referenceslm:000254716
formulaC65H120O6
global charge0
mol weight997.669
InChIKeyPUJTYHDREIZLHY-ACMVZKJYSA-N
InChIInChI=1S/C65H120O6/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-36-38-40-42-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-41-39-37-35-28-26-24-22-20-17-14-11-8-5-2/h17,20,24,26,35,37,62H,4-16,18-19,21-23,25,27-34,36,38-61H2,1-3H3/b20-17-,26-24-,37-35-/t62-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H120O6/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-36-38-40-42-44-47-50-53-56-59-65(68)71-62(60-69-63(66)57-54-51-48-45-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-41-39-37-35-28-26-24-22-20-17-14-11-8-5-2/h17,20,24,26,35,37,62H,4-16,18-19,21-23,25,27-34,36,38-61H2,1-3H3/b20-17-,26-24-,37-35-/t62-/m0/s1 Image of MNXM185137
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:65](=[O:68])[O:71][C@@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:66])[CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:41][CH2:39]/[CH:37]=[CH:35]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:67]
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:000254716
slm:000254716
PUJTYHDREIZLHY-ACMVZKJYSA-N
1-(10Z,13Z,16Z-docosatrienoyl)-2-octacosanoyl-3-dodecanoyl-sn-glycerol
TG(22:3(10Z,13Z,16Z)/28:0/12:0)
Triacylglycerol (22:3(10Z,13Z,16Z)/28:0/12:0)