11-Hydroxycinerubin A
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11-Hydroxycinerubin A
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CAS No:
76264-94-3
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Formula:
C42H53NO17
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Chemical Name:
11-Hydroxycinerubin A
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Synonyms:
epsilon-ISORMN-A;11-Hydroxycinerubin A;76264-94-3;1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-6,11-dioxo-2-ethyl-2,5,7,10,12-pentahydroxy-4-((2,3,6-trideoxy-4-O-(2,6-dideoxy-4-O-((2R-trans)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-, methyl ester, (1R-(1-alpha,2-beta,4-beta))-;G-6;DTXSID10227125
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CAS No:
Computed Properties
Molecular Weight:843.9
XLogP3:3.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:843.33134922
Monoisotopic Mass:843.33134922
Topological Polar Surface Area:258
Heavy Atom Count:60
Complexity:1600
Defined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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