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1-(9Z,12Z-hexadecadienoyl)-2-heneicosanoyl-3-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM324654 Image of MNXM324654
referenceslm:000200683
formulaC60H106O6
global charge0
mol weight923.502
InChIKeyUUJPYBMYLWIZLU-BNUDPCQQSA-N
InChIInChI=1S/C60H106O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-36-39-42-45-48-51-54-60(63)66-57(55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-30-28-26-23-20-17-14-11-8-5-2/h12,15,17,20-21,24,26,28,32,35,57H,4-11,13-14,16,18-19,22-23,25,27,29-31,33-34,36-56H2,1-3H3/b15-12-,20-17-,24-21-,28-26-,35-32-/t57-/m1/s1
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H106O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-36-39-42-45-48-51-54-60(63)66-57(55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-30-28-26-23-20-17-14-11-8-5-2/h12,15,17,20-21,24,26,28,32,35,57H,4-11,13-14,16,18-19,22-23,25,27,29-31,33-34,36-56H2,1-3H3/b15-12-,20-17-,24-21-,28-26-,35-32-/t57-/m1/s1 Image of MNXM324654
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][C:60](=[O:63])[O:66][C@H:57]([CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34]/[CH:24]=[CH:21]\[CH2:18]/[CH:15]=[CH:12]\[CH2:9][CH2:6][CH3:3])=[O:61])[CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38]/[CH:35]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[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:000200683
slm:000200683
UUJPYBMYLWIZLU-BNUDPCQQSA-N
1-(9Z,12Z-hexadecadienoyl)-2-heneicosanoyl-3-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol
TG(16:2(9Z,12Z)/21:0/20:3(8Z,11Z,14Z))
Triacylglycerol (16:2(9Z,12Z)/21:0/20:3(8Z,11Z,14Z))