TG(16:1(9Z)/O-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Properties Image MNX_ID MNXM135000 reference hmdb:HMDB0049071 formula C59H102O5 global charge 0 mol weight 891.46 InChIKey KKMRSKQHWIOZKQ-ZLUXARIRSA-N InChI InChI=1S/C59H102O5/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-35-38-41-44-47-50-53-59(61)64-56-57(55-63-58(60)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3)62-54-51-48-45-42-39-36-33-28-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-25,27,30-31,35,38,44,47,57H,4-6,8-9,11-15,17-18,20,22-23,26,28-29,32-34,36-37,39-43,45-46,48-56H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,31-30-,38-35-,47-44-/t57-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)OCCCCCCCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C59H102O5/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-35-38-41-44-47-50-53-59(61)64-56-57(55-63-58(60)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3)62-54-51-48-45-42-39-36-33-28-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-25,27,30-31,35,38,44,47,57H,4-6,8-9,11-15,17-18,20,22-23,26,28-29,32-34,36-37,39-43,45-46,48-56H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,31-30-,38-35-,47-44-/t57-/m0/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:35]=[CH:38]\[CH2:41]/[CH:44]=[CH:47]\[CH2:50][CH2:53][C:59](=[O:61])[O:64][CH2:56][C@H:57]([CH2:55][O:63][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:60])[O:62][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:28][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0