Aklaviketone

methyl (1R,2R)-2-ethyl-2,5,7-trihydroxy-4,6,11-trioxo-1,3-dihydrotetracene-1-carboxylate

Also Known As: Aklaviketone|S-383-Y|S 383-Y|methyl (1R,2R)-2-ethyl-2,5,7-trihydroxy-4,6,11-trioxo-1,3-dihydrotetracene-1-carboxylate|methyl (1R,2R)-2-ethyl-2,5,7-trihydroxy-4,6,11-trioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate|N-[2-(2-chloro-3-oxobutyl)sulfanylethyl]acetamide|1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-4,6,11-trioxo-, methyl ester, (1R-trans)-|(1R,2R)-2-Ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-4,6,11-trioxo-1beta-naphthacenecarboxylic acid methyl ester|Methyl (1R,2R)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-4,6,11-trioxo-1-naphthacenecarboxylate

Molecular Formula	C22H18O8
Molecular Weight	410.10016 g/mol
LogP	3.2
Topological Polar Surface Area	138.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	3
Exact Mass	410.10016
Monoisotopic Mass	410.10016
Heavy Atoms	30
Complexity	777.0

Chemical Identifiers

CAS Number	116235-82-6
SMILES	CC[C@]1(CC(=O)C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O
InChIKey	MHAXMIHGEZOCTQ-HTAPYJJXSA-N