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Home > Encyclopedia > [(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate structure

[(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate 

structure
  • CAS No:

    5175-78-0

  • Formula:

    C25H32O6

  • Chemical Name:

    [(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

  • Synonyms:

    5175-78-0;NSC87316;DTXSID00966051;NSC-87316;3-(Acetyloxy)-5-hydroxy-19-oxocarda-14,20(22)-dienolide

[(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate Basic Attributes

428.5 g/mol

428.21988874 g/mol

87316

Characteristics

89.9 Ų

Computed Properties

Molecular Weight:428.5
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:428.21988874
Monoisotopic Mass:428.21988874
Topological Polar Surface Area:89.9
Heavy Atom Count:31
Complexity:888
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(3S,5S,8R,9S,10S,13R,17S)-10-formyl-5-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,6,7,8,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

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