Hydroxydione hydrogen succinate

4-[2-[(5R,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-4-oxobutanoic acid

CAS: 80-96-6

Molecular Formula	`C25H36O6`
Molecular Weight	432.5 g/mol
LogP	3.8
Topological Polar Surface Area	97.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	432.2512
Heavy Atoms	31
Complexity	774.0

Chemical Identifiers

CAS Number	80-96-6
SMILES	`CC12CCC(=O)CC1CCC3C2CCC4(C3CCC4C(=O)COC(=O)CCC(=O)O)C`
InChIKey	`KLRNMIUKAXHHFS-ZILYODKUSA-N`

📖 Product Overview

Hydroxydione hydrogen succinate (CAS: 80-96-6) is a chemical compound with molecular formula C25H36O6 and molecular weight 432.5 g/mol. Its IUPAC systematic name is 4-[2-[(5R,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-4-oxobutanoic acid. LogP 3.8 Topological Polar Surface Area 97.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 7 Exact Mass 432.2512 Heavy Atoms 31 Complexity 774.0 InChI Key: KLRNMIUKAXHHFS-ZILYODKUSA-N. SMILES: CC12CCC(=O)CC1CCC3C2CCC4(C3CCC4C(=O)COC(=O)CCC(=O)O)C.

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