Methyl (6Ar,7S,10Ar)-6A,7,12-Trihydroxy-3,8,10A-Trimethoxy-1-Methyl-6,10,11-Trioxo-6,6A,7,10,10A,11-Hexahydro-2-Tetracenecarboxylate

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Properties Simple | Detailed

Formula C24H22O11
IUPAC Name methyl (6ar,7s,10ar)-6a,7,12-trihydroxy-3,8,10a-tri(methoxy)-1-methyl-6,10,11-trioxo-7h-tetracene-2-carboxylate
Molecular Mass 486.425 g·mol−1
Heat of Formation -1583.2 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 519.3 Å 3
Surface Area 425.5 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -1.63 ± eV
Point Group Symmetry C1
Synonyms
  • (6ar,7s,10ar)-6a,7,12-trihydroxy-3,8,10a-trimethoxy-1-methyl-6,10,11-trioxo-7h-tetracene-2-carboxylic acid methyl ester
  • (6ar,7s,10ar)-6a,7,12-trihydroxy-6,10,11-triketo-3,8,10a-trimethoxy-1-methyl-7h-tetracene-2-carboxylic acid methyl ester
  • 2-naphthacenecarboxylic acid, 6,6a,7,10,10a,11-hexahydro-6a,7,12-trihydroxy-3,8,10a-trimethoxy-1-methyl-6,10,11-trioxo-, methyl ester, (6ar-(6aalpha,7alpha,10aalpha))-
  • 8-methoxy-elloramycinone
  • methyl (6ar,7s,10ar)-6a,7,12-trihydroxy-3,8,10a-trimethoxy-1-methyl-6,10,11-trioxo-7h-tetracene-2-carboxylate
CAS Number(s)
  • 121245-07-6
InChIKey QSPIPUXWSNFXCK-AGILITTLSA-N
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