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

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

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

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

structure
  • CAS No:

    6961-92-8

  • Formula:

    C25H38O6

  • Chemical Name:

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

  • Synonyms:

    6961-92-8;NSC62998;DTXSID40989709;NSC-62998;11-Hydroxy-20-oxopregnane-3,21-diyl diacetate

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

434.6 g/mol

434.26683893 g/mol

62998

Characteristics

89.9 Ų

Computed Properties

Molecular Weight:434.6
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:434.26683893
Monoisotopic Mass:434.26683893
Topological Polar Surface Area:89.9
Heavy Atom Count:31
Complexity:748
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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