(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

Catalog No. :
ACVIRV295
CAS No. :
4185-01-7
Molecular Formula :
C24H38O4
Molecular Weight :
390.56

IUPAC Name:(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid structure diagram
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Product Information

Product Name(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
IUPAC Name(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
Molecular FormulaC24H38O4
Molecular Weight390.56
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
InChI KeyWMUMZOAFCDOTRW-OVEHVULHSA-N
Synonym12-ALPHA-HYDROXY-3-OXO-5-BETA-CHOLANOICACID;3-Oxo-12α-hydroxy-5β-cholanoic Acid;12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid;3-keto-12α-hydroxy-5β-cholan-24-oic acid;Cholan-24-oic acid, 12-hydroxy-3-oxo-, (5β,12α)-;Ursodeoxycholic Acid Impurity 16;(R)-4-((5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid;5β-CHOLANIC ACID-12α-OL-3-ONE
CAS No.4185-01-7

Synthetic Route by SureRoute

1. ACVIRV295 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACTRMX927 route compound structure diagram
    ACTRMX927555-75-9
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  3. ACDMHG325 route compound structure diagram
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  5. reactant_3 route compound structure diagram
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  6. Then
  7. ACVIRV295 route product structure diagram
    ACVIRV2954185-01-7
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2. ACVIRV295 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACVIRV295 route product structure diagram
    ACVIRV2954185-01-7
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