Kerriamycin A
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Kerriamycin A
structure -
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CAS No:
98474-20-5
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Formula:
C43H54O17
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Chemical Name:
Kerriamycin A
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Synonyms:
kerriamycin A;Kerriamycin A;98474-20-5;(4aR,12bS)-3,4a,8-trihydroxy-9-[(2R,4R,5R,6R)-5-hydroxy-4-[(2S,5S,6S)-5-[(2S,5R,6R)-5-hydroxy-6-methyl-4-oxooxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-12b-[(2S,5S,6S)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,1;Benz(a)anthracene-1,7,12(2H)-trione, 9-(2,6-dideoxy-3-O-((2S-(2alpha,5beta,6beta))-5-((2,6-dideoxy-beta-L-erythro-hexopyranos-3-ulos-1-yl)oxy)tetrahydro-6-methyl-2H-pyran-2-yl)-beta-D-arabino-hexopyranosyl)-3,4,4a,12b-tetrahydro-3,4a,8-trihydrox
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CAS No:
Computed Properties
Molecular Weight:842.9
XLogP3:0.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:7
Exact Mass:842.33610025
Monoisotopic Mass:842.33610025
Topological Polar Surface Area:254
Heavy Atom Count:60
Complexity:1780
Defined Atom Stereocenter Count:15
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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