Ponasterone C

Base Information

• Chemical Name: Ponasterone C
• CAS No.: 26191-89-9
• Molecular Formula: C27H44 O8
• Molecular Weight: 496.63
• UNII: VMC65WQM7J
• Nikkaji Number: J17.051H
• Wikidata: Q105216104
• Mol file: 26191-89-9.mol

Synonyms:Ponasteron;Ponasterone C;VMC65WQM7J;26191-89-9;(2S,3R,5S,9R,10R,13R,14S,17S)-2,3,5,14-Tetrahydroxy-10,13-dimethyl-17-((2R,3R,5S)-2,3,5-trihydroxy-6-methylheptan-2-yl)-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta(a)phenanthren-6-one;UNII-VMC65WQM7J;(2beta,3beta,5beta,22R,24S)-2,3,5,14,20,22,24-Heptahydroxycholest-7-en-6-one;5beta-Cholest-7-en-6-one, 2beta,3beta,5,14,20,22,24-heptahydroxy-, (22R)-;Cholest-7-en-6-one, 2,3,5,14,20,22,24-heptahydroxy-, (2beta,3beta,5beta,22R,24S)-;(2.BETA.,3.BETA.,5.BETA.,22R,24S)-2,3,5,14,20,22,24-HEPTAHYDROXYCHOLEST-7-EN-6-ONE;5.BETA.-CHOLEST-7-EN-6-ONE, 2.BETA.,3.BETA.,5,14,20,22,24-HEPTAHYDROXY-, (22R)-;CHOLEST-7-EN-6-ONE, 2,3,5,14,20,22,24-HEPTAHYDROXY-, (2.BETA.,3.BETA.,5.BETA.,22R,24S)-

Chemical Property of Ponasterone C

Chemical Property:

• PSA: 158.68000
• LogP: 0.82480
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 496.30361836
• Heavy Atom Count: 35
• Complexity: 904

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(CC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4(C3(CC(C(C4)O)O)C)O)C)O)O)O)O
• Isomeric SMILES: CC(C)[C@H](C[C@H]([C@@](C)([C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@]4([C@@]3(C[C@@H]([C@@H](C4)O)O)C)O)C)O)O)O)O

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