TOCOTRIENOL

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Synonyms
Status
Molecule Category Free-form
UNII 0867I0N41V

Structure

InChI Key GJJVAFUKOBZPCB-UHFFFAOYSA-N
Smiles CC(C)=CCCC(C)=CCCC(C)=CCCC1(C)CCc2cc(O)ccc2O1
InChI
InChI=1S/C26H38O2/c1-20(2)9-6-10-21(3)11-7-12-22(4)13-8-17-26(5)18-16-23-19-24(27)14-15-25(23)28-26/h9,11,13-15,19,27H,6-8,10,12,16-18H2,1-5H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H38O2
Molecular Weight 382.59
AlogP 7.68
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 9.0
Polar Surface Area 29.46
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 28.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL4297330
FDA SRS 0867I0N41V
PubChem 9929901
SureChEMBL SCHEMBL1081622
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