
IUPAC name
(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol
SMILES
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=C(O1)C(C)=C(C)C(O)=C2C
Compound class
Antioxidants; Vitamins; Dietary Supplements; Micronutrients; Supplements;
Therapeutic area
Vitamin E, known for its antioxidant activities, is protective against cardiovascular disease and some forms of cancer and has also demonstrated immune-enhancing effects. It may be of limited benefit in some with asthma and rheumatoid arthritis. It may be helpful in some neurological diseases including Alzheimer's, some eye disorders including cataracts, and diabetes and premenstrual syndrome. It may also help protect skin from ultraviolet irradiation although claims that it reverses skin aging, enhances male fertility and exercise performance are poorly supported. It may help relieve some muscle cramps.
Common name
Vitamin E
IUPAC name
(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol
SMILES
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=C(O1)C(C)=C(C)C(O)=C2C
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
FORMULA
C29H50O2

Common name
Vitamin E
IUPAC name
(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol
Molecular weight
430.706
clogP
9.753
clogS
-9.162
HBond Acceptor
2
HBond Donor
1
Total Polar
Surface Area
29.46
Number of Rings
2
Rotatable Bond
12
Drug ID | Common name | Structure CAS | SMILE | Frequency |
---|---|---|---|---|
FDBF00007 | propane |
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C(C)C | 0.2412 |
FDBF00012 | isobutane |
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C(C)(C)C | 0.0611 |
FDBF00067 | butane |
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CCCC | 0.0680 |
FDBF00115 | 2-methylbutane |
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C(C)(C)CC | 0.0103 |
FDBF00122 | (E)-pent-2-ene |
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C(=CCC)C | 0.0024 |
FDBF00123 | (E)-4-methylpent-2-ene |
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C(=CC(C)C)C | 0.0007 |
FDBF00125 | 3-methylpentane |
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CCC(C)CC | 0.0024 |
FDBF00126 | (E)-2-methylhept-3-ene |
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C(=CC(C)C)CCC | 0.0007 |
FDBF00127 | (3R)-3-methylhexane |
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C(C)CC(C)CC | 0.0007 |
FDBF00130 | (E)-2,6-dimethylhept-3-ene |
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C(=CC(C)C)CC(C)C | 0.0003 |