(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol
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![(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f407fe2d64494de3bcb2c07ad909e2fd.png "(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol")
(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol
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CAS No:
38818-67-6
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Formula:
C15H22O4
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Chemical Name:
(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol
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Synonyms:
3,15-dideacetylcalonectrin;3,15-dihydroxy-12,13-epoxytrichothec-9-ene;isoverrucarol;Isoverrucarol;UNII-DOT2G8E75A;DOT2G8E75A;38818-67-6;3,15-Didesacetylcalonectrin;DTXSID10959611;12,13-Epoxytrichothec-9-ene-3,15-diol;3,15-Dihydroxy-12,13-epoxytrichothec-9-ene;Q27276513;Tricothec-9-ene-3,15-diol, 12,13-epoxy-, (3alpha)-
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CAS No:
(1R,2R,7R,9R,10R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-ol Basic Attributes
266.33 g/mol
266.15180918 g/mol
DOT2G8E75A
Computed Properties
Molecular Weight:266.33
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:266.15180918
Monoisotopic Mass:266.15180918
Topological Polar Surface Area:62.2
Heavy Atom Count:19
Complexity:461
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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