(8S,10S)-8-Glycoloyl-6,8,11-Trihydroxy-10-{[(2R,4S,6R)-4-Hydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl]Oxy}-1-Methoxy-7,8,9,10-Tetrahydro-5,12-Tetracenedione

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Properties Simple | Detailed

Formula C21H14O11
IUPAC Name formaldehyde; (5-methylenetetrahydrofuran-3-ylidene)methanone; 2,5,6-tris(oxomethylene)-3h-indene-1,4,7-trione
Molecular Mass 442.329 g·mol−1
Heat of Formation -1790.9 ± 16.7 kJ·mol−1
Dipole Moment 5.96 ± 1.08 D
Volume 572.13 Å 3
Surface Area 468.21 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -1.61 ± eV
Point Group Symmetry C1
Synonyms
  • (2s-(2alpha(8r*,10r*),4beta,6beta))-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-((tetrahydro-4-hydroxy-6-methyl-2h-pyran-2-yl)oxy)-5,12-naphthacenedione
  • (7s,9s)-6,9,11-trihydroxy-7-[[(2r,4s,6r)-4-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-9-(2-hydroxy-1-oxoethyl)-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[(2r,4s,6r)-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[(2r,4s,6r)-4-hydroxy-6-methyloxan-2-yl]oxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-6,9,11-trihydroxy-9-(2-hydroxyethanoyl)-7-[(2r,4s,6r)-4-hydroxy-6-methyl-oxan-2-yl]oxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
  • (7s,9s)-9-glycoloyl-6,9,11-trihydroxy-7-[(2r,4s,6r)-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-quinone
  • 3'-hydroxyesorubicin
  • 5,12-naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-((tetrahydro-4-hydroxy-6-methyl-2h-pyran-2-yl)oxy)-, (2s-(2alpha(8r*,10r*),4beta,6beta))-
CAS Number(s)
  • 130592-19-7
InChIKey TZBDURDLNXOXBK-HWDYCMBPSA-N
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