1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone
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![1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9bfad53544d74d4c9a5be09c866c0f60.png "1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone")
1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone
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CAS No:
73025-63-5
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Formula:
C27H31NO11
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Chemical Name:
1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone
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Synonyms:
73025-63-5;Adriamycin semiquinone free radical;DTXSID70993793;(8S-cis)-10-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexapyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11,12-tetrahydro-8-(hydroxyacetyl)-1-methoxy-5-naphthacenyloxy;5-Naphthacenyloxy, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexapyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11,12-tetrahydro-8-(hydroxyacetyl)-1-methoxy-, (8S-cis)-;3,5,6,11,12-Pentahydroxy-3-(hydroxyacetyl)-10-methoxy-1,2,3,4-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside
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CAS No:
1-[4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,6,11,12-pentahydroxy-7-methoxy-3,4-dihydro-1H-tetracen-2-yl]-2-hydroxyethanone Basic Attributes
545.5 g/mol
545.18971080 g/mol
Computed Properties
Molecular Weight:545.5
XLogP3:2.1
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:545.18971080
Monoisotopic Mass:545.18971080
Topological Polar Surface Area:212
Heavy Atom Count:39
Complexity:894
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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