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CAS 104239-97-6

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3-Oxo-4-aza-5α-androst-1-ene-17β-carboxylic acid

Description:
3-Oxo-4-aza-5α-androst-1-ene-17β-carboxylic acid, with the CAS number 104239-97-6, is a synthetic compound that belongs to the class of steroid derivatives. This substance features a unique structure characterized by the presence of a nitrogen atom in the steroid framework, which classifies it as an aza-steroid. The compound contains a ketone functional group at the 3-position and a carboxylic acid group at the 17β position, contributing to its potential biological activity. It is often studied for its interactions with steroid receptors and its potential applications in medicinal chemistry, particularly in the development of anabolic agents or hormone modulators. The presence of the aza group may influence its pharmacokinetic properties, such as solubility and metabolic stability. As with many steroid derivatives, the compound may exhibit a range of biological effects, including anabolic or androgenic activities, making it of interest in both pharmaceutical research and therapeutic applications. However, specific biological activities and safety profiles would require further investigation through empirical studies.
Formula:C19H27NO3
InChI:InChI=1S/C19H27NO3/c1-18-9-7-13-11(12(18)4-5-14(18)17(22)23)3-6-15-19(13,2)10-8-16(21)20-15/h8,10-15H,3-7,9H2,1-2H3,(H,20,21)(H,22,23)/t11-,12-,13-,14+,15+,18-,19+/m0/s1
InChI key:InChIKey=FDESQZBVTKLIQN-MLGOENBGSA-N
SMILES:C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](C(O)=O)CC4)[H])(CC[C@]1(NC(=O)C=C2)[H])[H])[H]
Synonyms:
  • (4aR,4bS,6aS,7S,9aS,9bS,11aR)-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-Tetradecahydro-4a,6a-dimethyl-2-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic acid
  • (4aR,4bS,6aS,7S,9aS,9bS,11aR)-4a,6a-dimethyl-2-oxo-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-indeno[5,4-f]quinoline-7-Carboxylic acid
  • (5alpha,17Beta)-3-OXO-4-Azaandrost-1-ene-17-Carboxylic acid
  • (5α,17β)-N-[(2,5-Bis(trifluoromethyl)-phenyl]-3-oxo-4-aza-5-androst-1-ene-17-carboxylic acid
  • 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-4a,6a-dimethyl-2-oxo-, (4aR,4bS,6aS,7S,9aS,9bS,11aR)-
  • 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-4a,6a-dimethyl-2-oxo-, [4aR-(4aα,4bβ,6aα,7α,9aβ,9bα,11aβ)]-
  • 3-Oxo-4-aza-5a-androst-1-ene-17-Carboxylic acid
  • 3-Oxo-4-aza-5a-androst-1-ene-17b-carboxylicAcid
  • 3-Oxo-4-aza-5α-androst-1-ene-17β-carboxylic acid
  • 4-Aza-5alpha-Androsta-1-en-3-One-17Beta-Carboxylic acid
  • See more synonyms
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