10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid
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![10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0c4cb1c5d11741ddb9042c160da88695.png "10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid")
10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid
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CAS No:
81331-37-5
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Formula:
C15H20O6
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Chemical Name:
10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid
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Synonyms:
NSC325631;81331-37-5;Trichothec-9-en-15-oic acid, 12,13-epoxy-3,4-dihydroxy-;NSC 325631;DTXSID101001927;NSC-325631;3,4-Dihydroxy-12,13-epoxytrichothec-9-en-15-oic acid;dihydroxy(dimethyl)spiro[[?]-2,2'-oxirane]carboxylic acid
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CAS No:
10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-carboxylic acid Basic Attributes
296.31 g/mol
296.12598835 g/mol
325631
Computed Properties
Molecular Weight:296.31
XLogP3:-1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:296.12598835
Monoisotopic Mass:296.12598835
Topological Polar Surface Area:99.5
Heavy Atom Count:21
Complexity:558
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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