[6-[6-[(3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-4-dimethylamino-2-methyl-oxan-3-yl]oxy-2-methyl-3-(6-methyl-5-oxo-oxan-2-yl)oxy-oxan-4-yl]acetate
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[6-[6-[(3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-4-dimethylamino-2-methyl-oxan-3-yl]oxy-2-methyl-3-(6-methyl-5-oxo-oxan-2-yl)oxy-oxan-4-yl]acetate
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CAS No:
81975-92-0
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Formula:
C42H51NO16
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Chemical Name:
[6-[6-[(3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-4-dimethylamino-2-methyl-oxan-3-yl]oxy-2-methyl-3-(6-methyl-5-oxo-oxan-2-yl)oxy-oxan-4-yl]acetate
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Synonyms:
DTXSID201002354;5,12-Naphthacenedione, 7,8,9,10-tetrahydro-8-acetyl-10-((4-O-(3-O-acetyl-2,6-dideoxy-4-O-((2R-trans)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-1,6,8,11-tetrahydroxy-, (8S-cis)-,hydrate;LS-94005;3-Acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 4-O-[3-O-acetyl-2,6-dideoxy-4-O-(6-methyl-5-oxooxan-2-yl)hexopyranosyl]-2,3,6-trideoxy-3-(dimethylamino)hexopyranoside
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CAS No:
[6-[6-[(3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-4-dimethylamino-2-methyl-oxan-3-yl]oxy-2-methyl-3-(6-methyl-5-oxo-oxan-2-yl)oxy-oxan-4-yl]acetate Basic Attributes
825.861
825.321
Computed Properties
Molecular Weight:825.8
XLogP3:3.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:10
Exact Mass:825.32078454
Monoisotopic Mass:825.32078454
Topological Polar Surface Area:234
Heavy Atom Count:59
Complexity:1610
Undefined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
[6-[6-[(3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-4-dimethylamino-2-methyl-oxan-3-yl]oxy-2-methyl-3-(6-methyl-5-oxo-oxan-2-yl)oxy-oxan-4-yl]acetate
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