1'-methylascorbigen
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1'-methylascorbigen
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CAS No:
92557-61-4
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Formula:
C16H17NO6
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Chemical Name:
1'-methylascorbigen
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Synonyms:
1"-methylascorbigen;CCRIS 6834;C16H17NO6;beta-L-threo-L-glycero-3-Hexulofuranosonic acid, 2-C-((1-methyl-1H-indol-3-yl)methyl)-, gamma-lactone;LS-178174;A845848;(3S,3aR,6S,6aS)-3,6,6a-trihydroxy-6-[(1-methyl-3-indolyl)methyl]-3,3a-dihydro-2H-furo[3,2-b]furan-5-one;(3S,3aR,6S,6aS)-6-[(1-methylindol-3-yl)methyl]-3,6,6a-tris(oxidanyl)-3,3a-dihydro-2H-furo[3,2-b]furan-5-one;3a,5,6,6aalpha-Tetrahydro-3beta,3aalpha,6alpha-trihydroxy-3-(1-methyl-1H-indole-3-ylmethyl)furo[3,2-b]furan-2(3H)-one
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CAS No:
Computed Properties
Molecular Weight:319.31
XLogP3:-0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:319.10558726
Monoisotopic Mass:319.10558726
Topological Polar Surface Area:101
Heavy Atom Count:23
Complexity:515
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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