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Home > Encyclopedia > [(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

[(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate structure

[(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate 

structure
  • CAS No:

    15571-07-0

  • Formula:

    C25H32O6

  • Chemical Name:

    [(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

  • Synonyms:

    15571-07-0;Pachygenin-3-acetate;NSC87315;NSC 87315;BRN 0064348;3-Acetyl-delta(sup 5)-anhydrostrophanthidin;3-beta,14-Dihydroxy-19-oxocarda-5,20(22)-dienolide 3-acetate;NSC-87315;Carda-5,20(22)-dienolide, 3-(acetyloxy)-14-hydroxy-19-oxo-, (3-beta)-;CARDA-5,20(22)-DIENOLIDE, 3-beta,14-DIHYDROXY-19-OXO-, 3-ACETATE

[(3S,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate Basic Attributes

428.5 g/mol

428.21988874 g/mol

87315

Characteristics

89.9 Ų

Computed Properties

Molecular Weight:428.5
XLogP3:1.8
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,8R,9S,10S,13R,14S,17R)-10-formyl-14-hydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate

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