Bornesitol
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Bornesitol
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CAS No:
484-71-9
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Formula:
C7H14O6
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Chemical Name:
Bornesitol
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Synonyms:
D-myo-Inositol,1-O-methyl-;Inositol,1-O-methyl-,D-myo-;Bornesitol;1-O-Methyl-D-myo-inositol;D-(-)-Bornesitol;Bornesitol,(-)-;(-)-Bornesitol;D-Bornesitol
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CAS No:
Description
1D-1-O-methyl-myo-inositol is a member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2R,3S,4S,5R,6S-isomer). It has a role as a plant metabolite.
Computed Properties
Molecular Weight:194.18
XLogP3:-3.2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:194.07903816
Monoisotopic Mass:194.07903816
Topological Polar Surface Area:110
Heavy Atom Count:13
Complexity:158
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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