CAS 103335-55-3

3-Oxo-4-aza-5α-androstane-17β-carboxylic acid

Description:

3-Oxo-4-aza-5α-androstane-17β-carboxylic acid, identified by its CAS number 103335-55-3, is a synthetic compound that belongs to the class of androstane derivatives. This substance features a steroid backbone with a nitrogen atom incorporated into the structure, which classifies it as an aza-steroid. The presence of a ketone group at the 3-position and a carboxylic acid functional group at the 17β position contributes to its chemical reactivity and potential biological activity. The compound is of interest in medicinal chemistry, particularly in the development of pharmaceuticals targeting hormonal pathways. Its structural modifications may influence its binding affinity to steroid receptors, making it a candidate for research in areas such as hormone regulation and potential therapeutic applications. Additionally, the compound's solubility, stability, and interaction with biological systems are important characteristics that would be evaluated in further studies to understand its pharmacological properties.

Formula: C₁₉H₂₉NO₃

InChI: InChI=1S/C19H29NO3/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/h11-15H,3-10H2,1-2H3,(H,20,21)(H,22,23)/t11-,12-,13-,14+,15+,18-,19+/m0/s1

InChI key: InChIKey=MJXIPHMGYJXKLJ-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)CC2)[H])[H])[H]

Synonyms:

• (2R,3R,4Bs,6As,7S,9As,9Bs)-4A,6A-Dimethyl-2-Oxo-Hexadecahydro-Indeno[5,4-F]Quinoline-7-Carboxylic Acid
• (4aR,4bS,6aS,7S,9aS,9bS)-4a,6a-Dimethyl-2-Oxo-2,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10-tetradecahydro-1H-indeno[5,4-f]quinoline-7-Carboxylic acid
• (4aR,4bS,6aS,7S,9aS,9bS,11aR)-4a,6a-Dimethyl-2-oxohexadecahydro-1H-indeno[5,4-f]quinoline-7-Carboxylic acid
• (4aR,4bS,6aS,7S,9aS,9bS,11aR)-Hexadecahydro-4a,6a-dimethyl-2-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic acid
• (5α,17β)-3-Oxo-4-aza-5α-androstane-17-carboxylic acid
• (5α,17β)-3-Oxo-4-azaandrostane-17-carboxylic acid
• 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, hexadecahydro-4a,6a-dimethyl-2-oxo-, (4aR,4bS,6aS,7S,9aS,9bS,11aR)-
• 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, hexadecahydro-4a,6a-dimethyl-2-oxo-, [4aR-(4aα,4bβ,6aα,7α,9aβ,9bα,11aβ)]-
• 3-Oxo-4-Aza-5-Alpha-Androstane-17-Beta-Carbocylic Acid
• 3-Oxo-4-Azaandrost-5-Een-17-Beta-Carbonzuur
• 3-Oxo-4-aza-5α-androstan-17β-carboxylic acid
• 3-Oxo-4-aza-5α-androstane-17-carboxylic acid
• 3-Oxo-4-aza-5α-androstane-17β-carboxylic acid
• 4-Aza-3-oxo-5α-androstane-17β-carboxylic acid
• 4-Aza-3-oxo-androstane-17β-carboxylic acid
• 4-Aza-5-Androsten-3-One-17-Beta-Carboxylic Acid
• 4-Aza-5-Androsten-3-One-17Beta-Carboxylicacid
• 4-Aza-5-Androsten-3-Oxo-17Β-Carboxylic Acid
• 4-Aza-5A-Androstan-3-One-17Carboxylicacid
• 4-Aza-5Α-Androstan-3-One-17Β-Carboxylic Acid
• 4-Aza-5Α-Androstan-3-Oxo-17Β-Carboxylic Acid
• 4-Azaandrostane-17-carboxylic acid, 3-oxo-, (5α,17β)-

3-Oxo-4-aza-5α-androstan-17β-carboxylic Acid

CAS: 103335-55-3

Formula: C₁₉H₂₉NO₃

Purity: >98.0%(T)(HPLC)

Color and Shape: White to Light yellow powder to crystal

Molecular weight: 319.45

Ref: 3B-O0514

(4aR,4bS,6aS,7S,9aS,9bS,11aR)-Hexadecahydro-4a,6a-dimethyl-2-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic acid

CAS: 103335-55-3

Formula: C₁₉H₂₉NO₃

Purity: 98%

Color and Shape: Solid

Molecular weight: 319.4385

Ref: IN-DA008R10

4-Aza-3-Oxo-5α-Androstane-17β-Carboxylic Acid

CAS: 103335-55-3

4-Aza-3-Oxo-5α-Androstane-17β-Carboxylic Acid

Purity: 98%

Molecular weight: 319.44g/mol

Ref: 54-OR1027751

3-Oxo-4-aza-5α-androstane-17β-carboxylic Acid

CAS: 103335-55-3

Color and Shape: Neat

Ref: 86-MM0415.04

Dutasteride Impurity 3

CAS: 103335-55-3

Formula: C₁₉H₂₉NO₃

Molecular weight: 319.45

Ref: 4Z-D-3523

3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid

CAS: 103335-55-3

3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid is a versatile building block that can be used in the preparation of complex molecules. This compound is also a reagent, speciality chemical, and useful intermediate for organic synthesis. 3-Oxo-4-aza-5-alpha-androstane-17 beta carboxylic acid has been shown to be useful as a reaction component and scaffold in organic synthesis.

Formula: C₁₉H₂₉NO₃

Purity: Min. 95%

Color and Shape: White Clear Liquid

Molecular weight: 319.44 g/mol

Ref: 3D-FO74701

3-Oxo-4-aza-5a-androstan-17b-carboxylic Acid

Controlled Product

CAS: 103335-55-3

Applications 3-Oxo-4-aza-5α-androstan-17β-carboxylic Acid is an impurity in the synthetic process of Dutasteride (D735000), a dual inhibitor of 5α-reductase isoenzymes type 1 and 2; structurally related to Finasteride (F342000). Dutasteride is used in the treatment of benign prostatic hyperplasia.
References Zhang, K. et al.: J. Chin. Pharm. Sci., 16, 233 (2007); Bakshi, R.K., et al.: J. Med. Chem., 38, 3189 (1995), Gisleskog, P.O., et al.: Brit. J. Clin. Pharmacol., 47, 53 (1999), Djavan, B., et al.: Expert Opin. Pharmacother., 6, 311 (2005),

Formula: C₁₉H₂₉NO₃

Color and Shape: Neat

Molecular weight: 319.44

Ref: TR-O869500

Finasteride Dihydro Carboxylic Acid

CAS: 103335-55-3

Formula: C₁₉H₂₉NO₃

Molecular weight: 319.45

Ref: ST-EA-CP-F14007