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(7S,9S)-9-acetyl-4,6,9,11-tetrahydroxy-7-[(2R,4S,5S,6S)-5-hydroxy-4-[[2-(6-hydroxyhexylamino)-3,4-diketo-1-cyclobutenyl]amino]-6-methyl-tetrahydropyran-2-yl]oxy-8,10-dihydro-7H-tetracene-5,12-quinone

Compound with spectra: 1 NMR

(7S,9S)-9-acetyl-4,6,9,11-tetrahydroxy-7-[(2R,4S,5S,6S)-5-hydroxy-4-[[2-(6-hydroxyhexylamino)-3,4-diketo-1-cyclobutenyl]amino]-6-methyl-tetrahydropyran-2-yl]oxy-8,10-dihydro-7H-tetracene-5,12-quinone
SpectraBase Compound ID HVGRA1zmDrh
InChI InChI=1S/C36H40N2O13/c1-15-29(42)19(38-28-27(34(47)35(28)48)37-10-5-3-4-6-11-39)12-22(50-15)51-21-14-36(49,16(2)40)13-18-24(21)33(46)26-25(31(18)44)30(43)17-8-7-9-20(41)23(17)32(26)45/h7-9,15,19,21-22,29,37-39,41-42,44,46,49H,3-6,10-14H2,1-2H3/t15-,19-,21-,22-,29+,36-/m0/s1
InChIKey SLELQPZYQSHQDI-JBEFYAGCSA-N
Mol Weight 708.7 g/mol
Molecular Formula C36H40N2O13
Exact Mass 708.253039 g/mol
Enantiomer InChIKey SLELQPZYQSHQDI-LGMWMEJNSA-N

View Spectrum of (7S,9S)-9-acetyl-4,6,9,11-tetrahydroxy-7-[(2R,4S,5S,6S)-5-hydroxy-4-[[2-(6-hydroxyhexylamino)-3,4-diketo-1-cyclobutenyl]amino]-6-methyl-tetrahydropyran-2-yl]oxy-8,10-dihydro-7H-tetracene-5,12-quinone

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Title Journal or Book Year
A New Class of Semisynthetic Anthracycline Glycoside Antibiotics Incorporating a Squaric Acid Moiety The Journal of Antibiotics 2005
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