(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione
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![(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8ec22395835e4a019505c5b24c782642.png "(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione")
(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione
structure -
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CAS No:
136025-63-3
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Formula:
C20H28O3
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Chemical Name:
(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione
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Synonyms:
NSC692969;136025-63-3;NSC 692969;ent-3S-Hydroxy-atis-16(17)-en-1,14-dione;DTXSID60929228;3-Hydroxyatis-16-ene-2,14-dione;NSC-692969;Atis-16-ene-2,14-dione, 3-hydroxy-, (3alpha,5beta,8alpha,9beta,10alpha,12alpha)-;ent-3S-hydroxy-atis-16(17)-en-1,4-dione;(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylene-tetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione;Atis-16-ene-2,14-dione, 3-hydroxy-, (3.alpha.,5.beta.,8.alpha.,9.beta.,10.alpha.,12.alpha.)-
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CAS No:
(1S,4S,6S,9R,10S,12R)-6-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-7,14-dione Basic Attributes
316.4 g/mol
316.20384475 g/mol
692969
Computed Properties
Molecular Weight:316.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:316.20384475
Monoisotopic Mass:316.20384475
Topological Polar Surface Area:54.4
Heavy Atom Count:23
Complexity:618
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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