(1S,3R)-3,5,12-Trihydroxy-3-(Hydroxymethyl)-6,11-Dioxo-1,2,3,4,6,11-Hexahydro-1-Tetracenyl 2,6-Dideoxy-β-L-Lyxo-Hexopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C25H26O10
IUPAC Name (7s,9r)-7-[(2s,4s,5s,6s)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(hydroxymethyl)-8,10-dihydro-7h-tetracene-5,12-dione
Molecular Mass 486.468 g·mol−1
Heat of Formation -1665.3 ± 16.7 kJ·mol−1
Dipole Moment 5.47 ± 1.08 D
Volume 525.53 Å 3
Surface Area 433.24 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -1.44 ± eV
Point Group Symmetry C1
Synonyms
  • (7s,9r)-7-[(2s,4s,5s,6s)-4,5-dihydroxy-6-methyl-oxan-2-yl]oxy-6,9,11-trihydroxy-9-(hydroxymethyl)-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9r)-7-[(2s,4s,5s,6s)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-9-(hydroxymethyl)-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9r)-7-[(2s,4s,5s,6s)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-9-methylol-8,10-dihydro-7h-tetracene-5,12-quinone
  • (7s,9r)-7-[[(2s,4s,5s,6s)-4,5-dihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-6,9,11-trihydroxy-9-(hydroxymethyl)-8,10-dihydro-7h-tetracene-5,12-dione
  • 4-o-(2',6'-dideoxyhexopyranosyl)-1,2,3,4-tetrahydro-2,4,5,12-tetrahydroxy-2-hydroxymethyl-6,11-naphthacenedione
  • 5,12-naphthacenedione, 7-((2,6-dideoxy-alpha-l-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,9,11-trihydroxy-9-(hydroxymethyl)-, (7s-cis)-
  • dhtthn
CAS Number(s)
  • 100648-98-4
InChIKey VUZRLSUWFZKNKC-MUDRDAHASA-N
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