8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid
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![8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9490192d56d045f48380371f480fe3da.png "8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid")
8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid
structure -
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CAS No:
156250-74-7
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Formula:
C23H28O6
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Chemical Name:
8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid
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Synonyms:
harzianum A;harzianum B;trichodermyl 2',4',6'-octatriendioate;Harzianum A;156250-74-7
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CAS No:
8-oxo-8-(1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl)oxyocta-2,4,6-trienoic acid Basic Attributes
400.5 g/mol
400.18858861 g/mol
Computed Properties
Molecular Weight:400.5
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:400.18858861
Monoisotopic Mass:400.18858861
Topological Polar Surface Area:85.4
Heavy Atom Count:29
Complexity:838
Undefined Atom Stereocenter Count:6
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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