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CAS 1247-46-7

:

(1S,2S,5S)-2-(Acetyloxy)-1-methyl-5-[(2S)-1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl]cyclopentaneacetic acid

Description:
The chemical substance with the name "(1S,2S,5S)-2-(Acetyloxy)-1-methyl-5-[(2S)-1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl]cyclopentaneacetic acid" and CAS number 1247-46-7 is a complex organic compound characterized by its specific stereochemistry and functional groups. It features a cyclopentane ring substituted with an acetyloxy group and a naphthalene derivative, which contributes to its structural diversity and potential biological activity. The presence of the methoxy and keto functionalities suggests possible interactions with biological targets, making it of interest in medicinal chemistry. Its stereochemical configuration indicates that it may exhibit chirality, which can influence its pharmacological properties and interactions with enzymes or receptors. The compound's solubility, stability, and reactivity are influenced by its functional groups and overall structure, which are critical for its application in research or therapeutic contexts. Further studies would be necessary to elucidate its specific properties, including its mechanism of action and potential uses in pharmaceuticals.
Formula:C21H26O6
InChI:InChI=1S/C21H26O6/c1-12(22)27-18-9-8-17(21(18,2)11-19(23)24)16-6-4-13-10-14(26-3)5-7-15(13)20(16)25/h5,7,10,16-18H,4,6,8-9,11H2,1-3H3,(H,23,24)/t16-,17-,18-,21-/m0/s1
InChI key:InChIKey=UIYWWYIZBCCDGV-NTLWEQJWSA-N
SMILES:C(C(O)=O)[C@@]1(C)[C@@](CC[C@@H]1OC(C)=O)([C@]2(C(=O)C=3C(CC2)=CC(OC)=CC3)[H])[H]
Synonyms:
  • 17-Amosto
  • 3-Methoxy-9,11-seco-9-oxo-17β-acetoxyestra-1,3,5(10)-trien-11-oic acid
  • 3-Methoxy-9,11-seco-9-oxo-17beta-acetoxyestra-1,3,5(10)-trien-11-oic acid
  • 9,11-Secoestra-1,3,5(10)-trien-11-oic acid, 17beta-hydroxy-3-methoxy-9-oxo-, acetate
  • Cyclopentaneacetic acid, 2-(acetyloxy)-1-methyl-5-[(2S)-1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl]-, (1S,2S,5S)-
  • 9,11-Secoestra-1,3,5(10)-trien-11-oic acid, 17β-hydroxy-3-methoxy-9-oxo-, acetate
  • Cyclopentaneacetic acid, 2-(acetyloxy)-1-methyl-5-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, (1S-(1alpha,2beta,5beta(R*)))-
  • (1S,2S,5S)-2-(Acetyloxy)-1-methyl-5-[(2S)-1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl]cyclopentaneacetic acid
  • 2-[(1S,2S,5S)-2-acetoxy-5-(6-methoxy-1-oxo-tetralin-2-yl)-1-methyl-cyclopentyl]acetic acid
  • 17beta-Acetoxy-3-methoxy-9-oxo-9,11-secoestra-1,3,5(10)-trien-11-oic acid
  • Cyclopentaneacetic acid, 2-(acetyloxy)-1-methyl-5-(1,2,3,4-tetrahydro-6-methoxy-1-oxo-2-naphthalenyl)-, [1S-[1α,2β,5β(R*)]]-
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