tocopherol

Synonyms: "cumotocopherol", "neotocopherol", "p-xylotocopherol", "5,8-dimethyltocol"

Source: tocopherol is a naturally occurring chemical found in a variety of foods.

Identifiers:

IUPAC Name: (2R)-2,5,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
CAS Number: 148-03-8
PubChem ID: 6857447
InChiKey: WGVKWNUPNGFDFJ-DQCZWYHMSA-N
Canonical SMILES: CC1=CC(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O

Structural Properties:

Molecular Formula: C₂₈H₄₈O₂
Molecular Weight: 416.680

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 2
Number of atoms different from hydrogen: 30

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Rosenberg RS, Grass L, Jenkins DJ, Kendall CWC, Diamandis EP. 1998. Modulation of androgen and progesterone receptors by phytochemicals in breast cancer cell lines. Biochemical & Biophysical Research Communications 248(3):935-939.