(1S,3S)-3-Acetyl-3,5,12-Trihydroxy-10-Methoxy-6,11-Dioxo-1,2,3,4,6,11-Hexahydro-1-Tetracenyl β-D-Ribofuranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C26H26O12
IUPAC Name (2s)-2-(2,4-dioxobut-3-enoyl)-4-(oxomethylene)-5h-indeno[5,6-e][1,3]benzodioxole-6,7,8,9,10-pentone; formaldehyde
Molecular Mass 530.477 g·mol−1
Heat of Formation -1933.0 ± 16.7 kJ·mol−1
Dipole Moment 5.48 ± 1.08 D
Volume 565.66 Å 3
Surface Area 458.36 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -1.82 ± eV
Point Group Symmetry C1
Synonyms
  • (7s,9s)-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-9-ethanoyl-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-acetyl-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-acetyl-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-acetyl-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-quinone
  • (7s,9s)-9-acetyl-7-[[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • 7-o-(d-ribofuranosyl)daunomycinone
  • 7-o-rfdnm
  • 7-o-ribofuranosyldaunomycinone
CAS Number(s)
  • 105444-04-0
InChIKey OJTIHTGLDWDELH-MCDZYTKUSA-N
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