alpha-Tocopherol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 823
Total Number of Articles : 1250
PubChem 14985
Molecular Formula

C29H50O2

SMILES

CC1=C(C2=C(CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=C1O)C)C

InChI

InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m1/s1

synonyms
  • VITAMIN E
  • alpha-Tocopherol
  • 59-02-9
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Properties
Property Value
MW 430.7 g/mol
HBD 1
HBA 2
Rotatable Bond Count 12
Exact Mass 430.381080833 g/mol
Monoisotopic Mass 430.381080833 g/mol
Heavy Atom Count 31
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 503
xlogp 10.7
Topological Polar Surface Area 29.5