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Home > Encyclopedia > 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name)

1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name)

1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name) structure

1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name) 

structure
  • CAS No:

    138780-09-3

  • Formula:

    C32H52O3

  • Chemical Name:

    1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name)

1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name) Basic Attributes

484.75300

484.39164552 g/mol

Characteristics

35.53000

8.26270

1.04g/cm3

575.2ºC

294.6ºC

1.527

3.1E-13mmHg at 25°C

Drug Information

3 beta-tetrahydropyranyloxy-21-nor-5 alpha-ergost-24-en-20-one

Computed Properties

Molecular Weight:484.8
XLogP3:8.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:484.39164552
Monoisotopic Mass:484.39164552
Topological Polar Surface Area:35.5
Heavy Atom Count:35
Complexity:812
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-10,13-Dimethyl-3-(tetrahydro-2H- pyran-2-yloxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]-4, 5-dimethyl-4-hexen-1-one (non-preferred name)

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