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Gama-tocopheroxyl radical

PropertiesImage
MNX_IDMNXM164787 Image of MNXM164787
referencebiggM:CE7047
formulaC28H47O2
global charge0
mol weight415.682
InChIKeyLBDXFUVWQHFODO-OHCBOFHFSA-N
InChIInChI=1S/C28H47O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h19-22H,8-18H2,1-7H3/t21-,22-,28?/m0/s1
SMILESCC1=C(C)C(=O)C=C2CCC(C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O[C]21
MNX internals
InChI (mnx)InChI=1/C28H47O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h19-22H,8-18H2,1-7H3/t21-,22-,28?/m0/s1 Image of MNXM164787
SMILES (mnx)[CH3:1][CH:20]([CH3:2])[CH2:11][CH2:8][CH2:12][C@H:21]([CH3:3])[CH2:13][CH2:9][CH2:14][C@H:22]([CH3:4])[CH2:15][CH2:10][CH2:17][C:28]1([CH3:7])[CH2:18][CH2:16][C:25]2=[CH:19][C:26](=[O:29])[C:23]([CH3:5])=[C:24]([CH3:6])[C:27]2[O:30]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:CE7047
biggM:CE7047
LBDXFUVWQHFODO-OHCBOFHFSA-N
Gama-tocopheroxyl radical

biggM:M_CE7047
secondary/obsolete/fantasy identifier