1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-3-yl]ethanone
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1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-3-yl]ethanone
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CAS No:
145551-68-4
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Formula:
C18H30O2
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Chemical Name:
1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-3-yl]ethanone
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Synonyms:
1-(7-(2-hydroxyethyl)dodecahydro-3a-methyl-1H-benz(e)inden-3-yl)ethanone;3S-(3 alpha,3a alpha,5a beta,7 alpha,9a alpha,9b beta)-1-(7-(2-hydroxyethyl)dodecahydro-3a-methyl-1H-benz(e)inden-3-yl)ethanone;BI-1;BI-1;145551-68-4;CHEMBL209801;SCHEMBL8964991;DTXSID80932638;1-(7-(2-Hydroxyethyl)dodecahydro-3a-methyl-1H-benz(e)inden-3-yl)ethanone;3S-(3alpha,3aalpha,5abeta,7alpha,9aalpha,9bbeta)-1-(7-(2-Hydroxyethyl)dodecahydro-3a-methyl-1H-benz(e)inden-3-yl)ethanone;1-[7-(2-Hydroxyethyl)-3a-methyldodecahydro-1H-cyclopenta[a]naphthalen-3-yl]ethan-1-one;Ethanone, 1-(dodecahyro-7-(2-hydroxyethyl)-3a-methyl-1H-benz(e)inden-3-yl)-, (3S-(3alpha,3aalpha,5abeta,7alpha,9aalpha,9bbeta))-
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CAS No:
1-[(3S,3aS,5aR,7R,9aR,9bS)-7-(2-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-3-yl]ethanone Basic Attributes
278.4 g/mol
278.224580195 g/mol
Computed Properties
Molecular Weight:278.4
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:278.224580195
Monoisotopic Mass:278.224580195
Topological Polar Surface Area:37.3
Heavy Atom Count:20
Complexity:378
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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