148763-57-9
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148763-57-9
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CAS No:
148763-57-9
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Formula:
C42H48N2O18
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Chemical Name:
148763-57-9
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Synonyms:
Pradimicin A ethyl ester;D-Alanine, N-((5-((4,6-dideoxy-4-(methylamino)-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, ethyl ester, (5S-trans)-;148763-57-9
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CAS No:
Computed Properties
Molecular Weight:868.8
XLogP3:1.1
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:11
Exact Mass:868.29021269
Monoisotopic Mass:868.29021269
Topological Polar Surface Area:310
Heavy Atom Count:62
Complexity:1640
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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