TG(i-18:0/16:0/i-17:0)

Properties Image MNX_ID MNXM791496 reference hmdb:HMDB0108579 formula C54H104O6 global charge 0 mol weight 849.42 InChIKey SAMDKJFHFMAMNB-XHIZWQFQSA-N InChI InChI=1S/C54H104O6/c1-6-7-8-9-10-11-12-13-20-26-31-36-41-46-54(57)60-51(48-59-53(56)45-40-35-30-25-21-16-18-23-28-33-38-43-50(4)5)47-58-52(55)44-39-34-29-24-19-15-14-17-22-27-32-37-42-49(2)3/h49-51H,6-48H2,1-5H3/t51-/m0/s1 SMILES CCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C54H104O6/c1-6-7-8-9-10-11-12-13-20-26-31-36-41-46-54(57)60-51(48-59-53(56)45-40-35-30-25-21-16-18-23-28-33-38-43-50(4)5)47-58-52(55)44-39-34-29-24-19-15-14-17-22-27-32-37-42-49(2)3/h49-51H,6-48H2,1-5H3/t51-/m0/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:20][CH2:26][CH2:31][CH2:36][CH2:41][CH2:46][C:54](=[O:57])[O:60][C@@H:51]([CH2:47][O:58][C:52]([CH2:44][CH2:39][CH2:34][CH2:29][CH2:24][CH2:19][CH2:15][CH2:14][CH2:17][CH2:22][CH2:27][CH2:32][CH2:37][CH2:42][CH:49]([CH3:2])[CH3:3])=[O:55])[CH2:48][O:59][C:53]([CH2:45][CH2:40][CH2:35][CH2:30][CH2:25][CH2:21][CH2:16][CH2:18][CH2:23][CH2:28][CH2:33][CH2:38][CH2:43][CH:50]([CH3:4])[CH3:5])=[O:56]

Parent-child relations graph

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