(8S,10S)-8-[(1S)-1,2-Dihydroxyethyl]-6,8,10,11-Tetrahydroxy-1-Methoxy-7,8,9,10-Tetrahydro-5,12-Tetracenedione

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Properties Simple | Detailed

Formula C21H20O9
IUPAC Name (7s,9s)-9-[(1s)-1,2-dihydroxyethyl]-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
Molecular Mass 416.378 g·mol−1
Heat of Formation -1347.2 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 433.96 Å 3
Surface Area 369.03 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -1.52 ± eV
Point Group Symmetry C1
Synonyms
  • (7s,9s)-9-[(1s)-1,2-dihydroxyethyl]-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-[(1s)-1,2-dihydroxyethyl]-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-quinone
  • 13-dihydrodoxorubicinone
  • 4'-deoxydoxorubicinol 7-deoxyaglycone
  • 4-dol-done
  • 5,12-naphthacenedione, 8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-
CAS Number(s)
  • 56149-23-6
InChIKey CGVVIRBOJFDFBH-FPQVQZPGSA-N
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