Caryoptinol, 15-ethoxy-14,15-dihydro-2-hydroxy-, 3-(2-methylpropanoate), (2beta,3beta)-
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Caryoptinol, 15-ethoxy-14,15-dihydro-2-hydroxy-, 3-(2-methylpropanoate), (2beta,3beta)-
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CAS No:
79495-89-9
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Formula:
C30H46O11
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Chemical Name:
Caryoptinol, 15-ethoxy-14,15-dihydro-2-hydroxy-, 3-(2-methylpropanoate), (2beta,3beta)-
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Synonyms:
Ivain Iii;79495-89-9;DTXSID701000539;Caryoptinol, 15-ethoxy-14,15-dihydro-2-hydroxy-, 3-(2-methylpropanoate), (2beta,3beta)-;8-(Acetyloxy)-8a-[(acetyloxy)methyl]-5-(5-ethoxyhexahydrofuro[2,3-b]furan-2-yl)-3-hydroxy-5,6-dimethyloctahydro-2H-spiro[naphthalene-1,2'-oxiran]-2-yl 2-methylpropanoate;Propanoic acid, 2-methyl-, (1R,2S,3S,4aR,5S,6R,8S,8aR)-8-(acetyloxy)-8a-((acetyloxy)methyl)-5-((2S,3aS,6aR)-5-ethoxyhexahydrofuro(2,3-b)furan-2-yl)octahydro-3-hydroxy-5,6-dimethylspiro(naphthalene-1(2H),2'-oxiran)-2-yl ester;Propanoic acid, 2-methyl-, 8-(acetyloxy)-8a-((acetyloxy)methyl)-5-(5-ethoxyhexahydrofuro(2,3-b)furan-2-yl)octahydro-3-hydroxy-5,6-dimethylspiro(naphthalene-1(2H),2'-oxiran)-2-yl ester, (1R-(1alpha,2beta,3beta,4abeta,5beta(2S*,3aS*,6aR*),6alpha,8alpha,8aalpha))-(partial)-
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CAS No:
Caryoptinol, 15-ethoxy-14,15-dihydro-2-hydroxy-, 3-(2-methylpropanoate), (2beta,3beta)- Basic Attributes
582.7 g/mol
582.30401228 g/mol
Computed Properties
Molecular Weight:582.7
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:11
Exact Mass:582.30401228
Monoisotopic Mass:582.30401228
Topological Polar Surface Area:139
Heavy Atom Count:41
Complexity:1030
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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