(1S)-3-Glycoloyl-5,12-Dihydroxy-10-Methoxy-6,11-Dioxo-1,2,6,11-Tetrahydro-1-Tetracenyl 3-Amino-2,3,6-Trideoxy-α-L-Lyxo-Hexopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C27H27NO10
IUPAC Name (7s)-7-[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,11-dihydroxy-9-(2-hydroxyacetyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione
Molecular Mass 525.504 g·mol−1
Heat of Formation -1515.0 ± 16.7 kJ·mol−1
Dipole Moment 7.80 ± 1.08 D
Volume 567.59 Å 3
Surface Area 464.16 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -2.11 ± eV
Point Group Symmetry C1
Synonyms
  • (7s)-7-[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyl-oxan-2-yl]oxy-6,11-dihydroxy-9-(2-hydroxyethanoyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione
  • (7s)-7-[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,11-dihydroxy-9-(2-hydroxyacetyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione
  • (7s)-7-[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-9-glycoloyl-6,11-dihydroxy-4-methoxy-7,8-dihydrotetracene-5,12-quinone
  • (7s)-7-[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,11-dihydroxy-9-(2-hydroxyacetyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione
  • (7s)-7-[[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-6,11-dihydroxy-9-(2-hydroxy-1-oxoethyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione
  • 5,12-naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-l-lyxo-hexopyranosyl)oxy)-9,10-dihydro-6,11-dihydroxy-8-(hydroxyacetyl)-1-methoxy-, (s)-
  • 9,10-anhydroadriamycin
  • 9,10-anhydrodoxorubicin
CAS Number(s)
  • 80996-23-2
InChIKey GNZRKCZTDXRJOT-DYOIPSMXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N