beta-Tocopheryl quinone

Properties Image MNX_ID MNXM119754 reference chebi:168417 formula C28H48O3 global charge 0 mol weight 432.689 InChIKey ITLZIXCIULJMPV-UHFFFAOYSA-N InChI InChI=1S/C28H48O3/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7,31)18-16-25-24(6)26(29)19-23(5)27(25)30/h19-22,31H,8-18H2,1-7H3 SMILES CC1=CC(=O)C(C)=C(CCC(C)(O)CCCC(C)CCCC(C)CCCC(C)C)C1=O MNX internals InChI (mnx) InChI=1/C28H48O3/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7,31)18-16-25-24(6)26(29)19-23(5)27(25)30/h19-22,31H,8-18H2,1-7H3/t21?,22?,28? SMILES (mnx) [CH3:1][CH:20]([CH3:2])[CH2:11][CH2:8][CH2:12][CH:21]([CH3:3])[CH2:13][CH2:9][CH2:14][CH:22]([CH3:4])[CH2:15][CH2:10][CH2:17][C:28]([CH3:7])([CH2:18][CH2:16][C:25]1=[C:24]([CH3:6])[C:26](=[O:29])[CH:19]=[C:23]([CH3:5])[C:27]1=[O:30])[OH:31]

Parent-child relations graph

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