 Home > Encyclopedia > [(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate

[(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate

[(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate structure

CAS No:
21515-43-5
Formula:
C29H35NO7
Chemical Name:
[(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate
Synonyms:
21515-43-5;Go 2616;Strophanthidin-3-nicotinate;BRN 0070085;Nicotinic acid, ester with strophanthidin;DTXSID90944126;5-beta-Card-20(22)-enolide, 19-oxo-3-beta,5,14-trihydroxy-, 3-nicotinate;(3-beta,5-beta)-5,14-Dihydroxy-19-oxo-3-((3-pyridinylcarbonyl)oxy)card-20(22)-enolide;Card-20(22)-enolide, 5,14-dihydroxy-19-oxo-3-((3-pyridinylcarbonyl)oxy)-, (3-beta,5-beta)-;4-22-00-00385 (Beilstein Handbook Reference);5,14-Dihydroxy-19-oxo-3-[(pyridine-3-carbonyl)oxy]card-20(22)-enolide

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[(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate Basic Attributes

Molecular Weight：

509.6 g/mol

Exact Mass：

509.24135246 g/mol

Characteristics

PSA：

123 Å²

Computed Properties

Molecular Weight:509.6
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:509.24135246
Monoisotopic Mass:509.24135246
Topological Polar Surface Area:123
Heavy Atom Count:37
Complexity:1010
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] pyridine-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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