[(1S,2R,4S,7R,9S,10R,11S)-10,11-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-12-methylidene-8-oxatricyclo[7.2.1.02,7]dodec-5-en-4-yl] 3-methylbutanoate
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[(1S,2R,4S,7R,9S,10R,11S)-10,11-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-12-methylidene-8-oxatricyclo[7.2.1.02,7]dodec-5-en-4-yl] 3-methylbutanoate
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CAS No:
103668-89-9
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Formula:
C20H30O6
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Chemical Name:
[(1S,2R,4S,7R,9S,10R,11S)-10,11-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-12-methylidene-8-oxatricyclo[7.2.1.02,7]dodec-5-en-4-yl] 3-methylbutanoate
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Synonyms:
103668-89-9;DTXSID40908551;Trichotheca-9,12-diene-3,4,8,15-tetrol, 8-(3-methylbutanoate), (3alpha,4beta,8alpha)-;3,4,15-Trihydroxytrichotheca-9,12-dien-8-yl 3-methylbutanoate
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CAS No:
[(1S,2R,4S,7R,9S,10R,11S)-10,11-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-12-methylidene-8-oxatricyclo[7.2.1.02,7]dodec-5-en-4-yl] 3-methylbutanoate Basic Attributes
366.4 g/mol
366.20423867 g/mol
Computed Properties
Molecular Weight:366.4
XLogP3:0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:366.20423867
Monoisotopic Mass:366.20423867
Topological Polar Surface Area:96.2
Heavy Atom Count:26
Complexity:640
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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