3,7-DIKETO-5BETA-CHOLAN-24-OICACID
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3,7-DIKETO-5BETA-CHOLAN-24-OICACID
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CAS No:
859-97-2
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Formula:
C24H36O4
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Chemical Name:
3,7-DIKETO-5BETA-CHOLAN-24-OICACID
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Synonyms:
5B-cholanic acid 3,7-dione;3,7-diketo-5β-cholan-24-oic acid;5β-cholanic acid-3,7-dione;3,7-DIOXO-5-BETA-CHOLANOICACID;3,7-Diketo-5β-cholanic acid;3,7-Diketochenodeoxycholic acid;3,7-Dioxo-5β-cholan-24-oic acid;Dehydrochenodeoxycholic acid
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CAS No:
3,7-DIKETO-5BETA-CHOLAN-24-OICACID Use and Manufacturing
Lipids -> Sterol Lipids [ST] -> Bile acids and derivatives [ST04] -> C24 bile acids, alcohols, and derivatives [ST0401]
Computed Properties
Molecular Weight:388.5
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:388.26135963
Monoisotopic Mass:388.26135963
Topological Polar Surface Area:71.4
Heavy Atom Count:28
Complexity:684
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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