3-α-hydroxy-7-oxo-5-β-cholan-24-oic acid
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- ?.????: 3-α-hydroxy-7-oxo-5-β-cholan-24-oic acid
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?? ID
- ??: Chemicalbook
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- ???: 400-158-6606
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-30.21 ℃
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124.87 ℃
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15.3 ㎜Hg (25°C)
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9462 ㎎/? (25°C)
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3.5500862961684505
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0.83 (20°C)
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1.27 (Log Kow)
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102.846
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????LD50 1300 ㎎/㎏ ??? : Rat
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??? ???? ?? ?? ???????, ????? ??? (ACD/Tox Suite lists all the rules that are applicable and are used in the calculation, it highlights the structural fragments corresponding to the listed rules on the molecule of interest and it provides a list of up to five most similar structures from the training set with the experimental values of their standard Draize test result and references)(ECHA)
??? ???? ????????, ????? ???(ACD/Tox Suite lists all the rules that are applicable and are used in the calculation, it highlights the structural fragments corresponding to the listed rules on the molecule of interest and it provides a list of similar structures from the training set with the experimental values of their standard Draize test result and references)(ECHA)
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?????????, ????(“Protein binding by OASIS” and “Skin sensitization alerts implemented by Toxtree” are two profilers relevant for skin sensitization)(ECHA)
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in vitro ? ?? ??? ???? ??(bacterial reverse mutation assay)??, ?? (ACD/ToxSuite genotoxicity predictions are provided together with a reliability index which assesses the degree of confidence of the prediction. The reliability index (RI) takes into account the similarity of the tested compound with the training set compounds and the consistency of experimental values for similar compounds)(ECHA)
???(?/?)? ???? ? ?? ???? ????, ???? ??? ?? (The reproductive toxicity on male and female rodent of the five biliary acids was estimated by Leadscope FDA Model Applier)(ECHA)
??? ???? ????(??) ??????, ?? ??? ??? ??? LD50 1300mg/kg bw
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??LC50 > 100 ㎎/? 96 hr Brachydanio rerio
( ??(Danio rerio) 96h : LC50 > 100 mg/L )
EC50 > 100 ㎎/? 48 hr Daphnia magna
( ???(Daphnia magna) 48h : LC50 >100 mg/L )
EC50 > 100 ㎎/? 72 hr
(??(Pseudokirchneriella subcapitata) 72h : EC50 > 100 mg/L )
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???3.48 log Kow
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???112.99 BCF
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82 (%) 28 day
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414 Koc
(Kow method)
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