Pradimicin S
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Pradimicin S
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CAS No:
146446-02-8
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Formula:
C41H46N2O22S
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Chemical Name:
Pradimicin S
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Synonyms:
pradimicin S;Pradimicin S;146446-02-8;D-Alanine, N-((5-((4,6-dideoxy-4-(methylamino)-3-O-(3-O-sulfo-beta-D-glucopyranosyl)-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)-, (5S-trans)-;D-Alanine, N-((5-((4,6-dideoxy-4-(methylamino)-3-O-(3-O-sulfo-beta-D-glucopyranosyl)-beta-D-glactopyranosyl)oxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)-
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CAS No:
Computed Properties
Molecular Weight:950.9
XLogP3:-2.3
Hydrogen Bond Donor Count:12
Hydrogen Bond Acceptor Count:23
Rotatable Bond Count:12
Exact Mass:950.22629227
Monoisotopic Mass:950.22629227
Topological Polar Surface Area:393
Heavy Atom Count:66
Complexity:1910
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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