lithooxazoline
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lithooxazoline
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CAS No:
80724-92-1
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Formula:
C28H47NO2
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Chemical Name:
lithooxazoline
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Synonyms:
lithooxazoline;(3R,5R,8R,9S,10S,13R,14S,17R)-17-((R)-4-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)butan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-ol;CTK3E8427;(3R,5R,8R,9S,10S,13R,14S,17R)-17-[(2R)-4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)butan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol;24-Norcholan-3-ol, 23-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-, (3alpha,5beta)-
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CAS No:
Computed Properties
Molecular Weight:429.7
XLogP3:6.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:429.360679742
Monoisotopic Mass:429.360679742
Topological Polar Surface Area:41.8
Heavy Atom Count:31
Complexity:716
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes