What is the molecular formula of 4-Pregnen-16|-methyl-3,20-dione?
The molecular formula of 4-Pregnen-16|-methyl-3,20-dione is C22H32O2.
What is the molecular weight of 4-Pregnen-16|-methyl-3,20-dione?
The molecular weight of 4-Pregnen-16|-methyl-3,20-dione is 328.5 g/mol.
What is the IUPAC name of 4-Pregnen-16|-methyl-3,20-dione?
The IUPAC name of 4-Pregnen-16|-methyl-3,20-dione is (8S,9S,10R,13S,14S,16R,17S)-17-acetyl-10,13,16-trimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
What is the InChI of 4-Pregnen-16|-methyl-3,20-dione?
The InChI of 4-Pregnen-16|-methyl-3,20-dione is InChI=1S/C22H32O2/c1-13-11-19-17-6-5-15-12-16(24)7-9-21(15,3)18(17)8-10-22(19,4)20(13)14(2)23/h12-13,17-20H,5-11H2,1-4H3/t13-,17-,18+,19+,20-,21+,22+/m1/s1.
What is the InChIKey of 4-Pregnen-16|-methyl-3,20-dione?
The InChIKey of 4-Pregnen-16|-methyl-3,20-dione is JYYRDDFNMDZIIP-SMWISZJMSA-N.
What is the canonical SMILES of 4-Pregnen-16|-methyl-3,20-dione?
The canonical SMILES of 4-Pregnen-16|-methyl-3,20-dione is CC1CC2C3CCC4=CC(=O)CCC4(C3CCC2(C1C(=O)C)C)C.
What is the CAS number of 4-Pregnen-16|-methyl-3,20-dione?
The CAS number of 4-Pregnen-16|-methyl-3,20-dione is 1239-79-8.
What is the ChEMBL ID of 4-Pregnen-16|-methyl-3,20-dione?
The ChEMBL ID of 4-Pregnen-16|-methyl-3,20-dione is CHEMBL2311119.
What is the XLogP3 value of 4-Pregnen-16|-methyl-3,20-dione?
The XLogP3 value of 4-Pregnen-16|-methyl-3,20-dione is 4.3.
What is the hydrogen bond acceptor count of 4-Pregnen-16|-methyl-3,20-dione?
The hydrogen bond acceptor count of 4-Pregnen-16|-methyl-3,20-dione is 2.