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Home > Encyclopedia > 3,7-Dioxo-5α-cholan-24-oic acid methyl ester

3,7-Dioxo-5α-cholan-24-oic acid methyl ester

3,7-Dioxo-5α-cholan-24-oic acid methyl ester structure

3,7-Dioxo-5α-cholan-24-oic acid methyl ester 

structure
  • CAS No:

    16656-68-1

  • Formula:

    C25H38O4

  • Chemical Name:

    3,7-Dioxo-5α-cholan-24-oic acid methyl ester

  • Synonyms:

    5.alpha.-Cholan-24-oic acid, 3,7-dioxo-, methyl ester;methyl 3,7-diketo-5a-cholanoate;Methyl 3,7-dioxocholan-24-oate #;Methyl-3,7-diketo-5.alpha.-cholanoate;3,7-Dioxo-5alpha-cholan-24-oic acid methyl ester

3,7-Dioxo-5α-cholan-24-oic acid methyl ester Basic Attributes

402.56682

402.277

Characteristics

60.4

4.5

Computed Properties

Molecular Weight:402.6
XLogP3:4.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:402.27700969
Monoisotopic Mass:402.27700969
Topological Polar Surface Area:60.4
Heavy Atom Count:29
Complexity:699
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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