[(1R,2R,6R,7R,8R,9R,10S,12S)-12-hydroperoxy-9-hydroxy-3,9-dimethyl-13-methylidene-6-propan-2-yl-15-oxatricyclo[6.6.1.02,7]pentadec-3-en-10-yl] acetate
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[(1R,2R,6R,7R,8R,9R,10S,12S)-12-hydroperoxy-9-hydroxy-3,9-dimethyl-13-methylidene-6-propan-2-yl-15-oxatricyclo[6.6.1.02,7]pentadec-3-en-10-yl] acetate
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CAS No:
115834-33-8
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Formula:
C22H34O6
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Chemical Name:
[(1R,2R,6R,7R,8R,9R,10S,12S)-12-hydroperoxy-9-hydroxy-3,9-dimethyl-13-methylidene-6-propan-2-yl-15-oxatricyclo[6.6.1.02,7]pentadec-3-en-10-yl] acetate
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Synonyms:
alcyonin;Alcyonin;115834-33-8;DTXSID00921822;5,12-Epoxybenzocyclodecene-6,7-diol, 3,4,4a,5,6,7,8,9,10,11,12,12a-dodecahydro-9-hydroperoxy-1,6-dimethyl-10-methylene-4-(1-methylethyl)-, 7-acetate, (4R,4aR,5R,6R,7S,9S,12R,12aR)-;9-Hydroperoxy-6-hydroxy-1,6-dimethyl-10-methylidene-4-(propan-2-yl)-3,4,4a,5,6,7,8,9,10,11,12,12a-dodecahydro-5,12-epoxybenzo[10]annulen-7-yl acetate
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CAS No:
[(1R,2R,6R,7R,8R,9R,10S,12S)-12-hydroperoxy-9-hydroxy-3,9-dimethyl-13-methylidene-6-propan-2-yl-15-oxatricyclo[6.6.1.02,7]pentadec-3-en-10-yl] acetate Basic Attributes
394.5 g/mol
394.23553880 g/mol
Computed Properties
Molecular Weight:394.5
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:394.23553880
Monoisotopic Mass:394.23553880
Topological Polar Surface Area:85.2
Heavy Atom Count:28
Complexity:655
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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