Methyl (1R,2R,4S)-2-Ethyl-2,5,7-Trihydroxy-6,11-Dioxo-4-{[2,3,6-Trideoxy-3-(Dimethylamino)-α-L-Lyxo-Hexopyranosyl]Oxy}-1,2,3,4,6,11-Hexahydro-1-Tetracenecarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C30H35NO10
IUPAC Name (1r,2r,4s)-4-[(2r,4s,5s,6s)-4-(dimethylammonio)-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-2,7-dihydroxy-1-methoxycarbonyl-6,11-dioxo-3,4-dihydro-1h-tetracen-5-olate
Molecular Mass 569.600 g·mol−1
Heat of Formation -1654.0 ± 16.7 kJ·mol−1
Dipole Moment 2.80 ± 1.08 D
Volume 638.85 Å 3
Surface Area 502.05 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,4s)-4-[(2r,4s,5s,6s)-4-dimethylamino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-diketo-3,4-dihydro-1h-tetracene-1-carboxylic acid methyl ester
  • (1r,2r,4s)-4-[[(2r,4s,5s,6s)-4-dimethylamino-5-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1h-tetracene-1-carboxylic acid methyl ester
  • 1-deoxypyrromycin
  • 1-naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-4-((2,3,6-trideoxy-3-(dimethylamino)-alpha-l-lyxo-hexapyranosyl)oxy)-, methyl ester, (1r-(1-alpha,2-beta,4-beta))-
  • aclacinomycin t
  • aclacinomycins
  • antibiotic ma 144t1
  • doxypyrromycin
  • ma 144t1
  • methyl (1r,2r,4s)-4-[(2r,4s,5s,6s)-4-dimethylamino-5-hydroxy-6-methyl-oxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1h-tetracene-1-carboxylate
  • methyl (1r,2r,4s)-4-[(2r,4s,5s,6s)-4-dimethylamino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1h-tetracene-1-carboxylate
  • methyl (1r,2r,4s)-4-[(2r,4s,5s,6s)-4-dimethylamino-5-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1h-tetracene-1-carboxylate
  • sdccgmls-0066947.p001
  • siwenmycin
CAS Number(s)
  • 66676-88-8
  • 11002-83-8
  • 60504-57-6
InChIKey LJZPVWKMAYDYAS-QKKPTTNWSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N