(8S,10S)-8-Acetyl-6,8,10,11-Tetrahydroxy-1-Methoxy-7,8,9,10-Tetrahydro-5,12-Tetracenedione

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Properties Simple | Detailed

Formula C21H18O8
IUPAC Name (7s,9s)-9-acetyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
Molecular Mass 398.363 g·mol−1
Heat of Formation -1139.9 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 420.47 Å 3
Surface Area 357.9 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C1
Synonyms
  • (7s,9s)-9-acetyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-acetyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-quinone
  • (7s,9s)-9-ethanoyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • daunorubicinone
InChIKey YOFDHOWPGULAQF-MQJDWESPSA-N
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