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Home > Encyclopedia > [(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate

[(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate

[(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate structure

[(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate 

structure
  • CAS No:

    99571-97-8

  • Formula:

    C17H24O5

  • Chemical Name:

    [(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate

  • Synonyms:

    DTXSID50912624;99571-97-8;7-Hydroxy-12,13-epoxytrichothec-9-en-3-yl acetate

[(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate Basic Attributes

308.4 g/mol

308.16237386 g/mol

Characteristics

68.3 Ų

1.5817

Computed Properties

Molecular Weight:308.4
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:308.16237386
Monoisotopic Mass:308.16237386
Topological Polar Surface Area:68.3
Heavy Atom Count:22
Complexity:571
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(1R,2S,3R,7R,9R,10R)-3-hydroxy-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate

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