Auramycinone

methyl (1R,2R,4S)-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate

Also Known As: Auramycinone|methyl (1R,2R,4S)-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate|AG-H-13614|1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-, methyl ester, (1R-(1alpha,2beta,4beta))-|methyl (1R,2R,4S)-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate|methyl -2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate|(1R)-1,2,3,4,6,11-Hexahydro-2alpha,4alpha,5,7-tetrahydroxy-2-methyl-6,11-dioxo-1-naphthacenecarboxylic acid methyl ester|(1R,2R,4S)-2-Methyl-1,2,3,4,6,11-hexahydro-2,4,5,7-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid methyl ester|Methyl (1R,2R,4S)-1,2,3,4,6,11-hexahydro-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-1-naphthacenecarboxylate

Molecular Formula	C21H18O8
Molecular Weight	398.10016 g/mol
LogP	1.9
Topological Polar Surface Area	141.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	2
Exact Mass	398.10016
Monoisotopic Mass	398.10016
Heavy Atoms	29
Complexity	721.0

Chemical Identifiers

CAS Number	78173-89-4
SMILES	C[C@]1(C[C@@H](C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O)O
InChIKey	WCKNDRCJQZCZLO-LBJGKRIESA-N