(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one
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![(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/25dcb3f175414a8a89dadd602abfdea2.png "(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one")
(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one
structure -
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CAS No:
136025-64-4
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Formula:
C20H32O4
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Chemical Name:
(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one
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Synonyms:
ent-3S,16S,17-trihydroxy-kauran-2-one;136025-64-4;NSC692968;DTXSID20929229;3,16,17-Trihydroxykauran-2-one;ent-3S,17-trihydroxy-kauran-2-one;NSC-692968;Kauran-2-one, 3,16,17-trihydroxy-, (3alpha,16alpha)-;Kauran-2-one, 3,16,17-trihydroxy-, (3.alpha.,16.alpha.)-
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CAS No:
(1S,4S,6S,9S,10R,13R,14S)-6,14-dihydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one Basic Attributes
336.5 g/mol
336.23005950 g/mol
692968
Computed Properties
Molecular Weight:336.5
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:336.23005950
Monoisotopic Mass:336.23005950
Topological Polar Surface Area:77.8
Heavy Atom Count:24
Complexity:572
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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