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Home > Encyclopedia > methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate

methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate

methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate structure

methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate 

structure
  • CAS No:

    56085-36-0

  • Formula:

    C27H44O4

  • Chemical Name:

    methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate

  • Synonyms:

    Methyl acetyl-isolithocholate;Methyl 3-O-acetyl-isolithocholate;56085-36-0;DTXSID30971471;Methyl 3-(acetyloxy)cholan-24-oate;NSC226170;NSC-226170;Cholan-24-oic acid, methyl ester, (3.alpha.)-;5.beta.-Cholanic acid, 3.alpha.-hydroxy-, methyl ester, acetate;Cholan-24-oic acid, 3-(acetyloxy)-, methyl ester, (3.alpha.,5.beta.)-

methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate Basic Attributes

432.6 g/mol

432.32395988 g/mol

226170

Characteristics

52.6 Ų

Computed Properties

Molecular Weight:432.6
XLogP3:7.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:432.32395988
Monoisotopic Mass:432.32395988
Topological Polar Surface Area:52.6
Heavy Atom Count:31
Complexity:689
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 4-(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate

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