(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
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![(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/858a0e7134c1493cb090081a3326d432.png "(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione")
(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
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CAS No:
62414-00-0
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Formula:
C27H29NO11
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Chemical Name:
(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
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Synonyms:
3',4'-Diepi-6'-hydroxydaunorubicin;62414-00-0;5,12-Naphthacenedione, 8-acetyl-10-((3-amino-2,3-dideoxy-alpha-L-ribo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S-cis)-
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CAS No:
(9S)-9-acetyl-7-[(4R,5R,6S)-4-amino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione Basic Attributes
543.5 g/mol
543.17406074 g/mol
Computed Properties
Molecular Weight:543.5
XLogP3:1.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:543.17406074
Monoisotopic Mass:543.17406074
Topological Polar Surface Area:206
Heavy Atom Count:39
Complexity:977
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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