What is the molecular formula of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The molecular formula is C19H29NO3.
What is the molecular weight of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The molecular weight is 319.4 g/mol.
What is the IUPAC name of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The IUPAC name is (1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline-1-carboxylic acid.
What is the InChI of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The InChI is 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.
What is the InChIKey of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The InChIKey is MJXIPHMGYJXKLJ-MLGOENBGSA-N.
What is the canonical SMILES of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The canonical SMILES is CC12CCC3C(C1CCC2C(=O)O)CCC4C3(CCC(=O)N4)C.
What are the synonyms of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The synonyms are 103335-55-3, 4-Aza-5alpha-androstan-3-one-17beta-carboxylic acid, and (1S,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,8,9,9b,10,11-tetradecahydroindeno[5,4-f]quinoline-1-carboxylic acid.
What is the CAS number of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The CAS number is 103335-55-3.
What is the XLogP3-AA value of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The XLogP3-AA value is 3.3.
What is the hydrogen bond donor count of 3-Oxo-4-aza-5-alpha-androstane-17-beta-carboxylic acid?
The hydrogen bond donor count is 2.