Ascorbigen
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Ascorbigen
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CAS No:
8075-98-7
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Formula:
C15H15NO6
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Chemical Name:
Ascorbigen
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Synonyms:
α-L-threo-3-Hexulofuranosonic acid,2-C-(1H-indol-3-ylmethyl)-,γ-lactone,(2ξ)-;Ascorbigen;8075-99-8
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CAS No:
Description
ChEBI: An indolyl carbohydrate that consists of (3aS,6S,6aR)-3,3a,6-trihydroxy-3-tetrahydrofuro[3,2-b]furan-2-one in which position 3 is substituted by an indol-3-ylmethyl group. Formed from indole-3 carbinol and ascorbic acid in brassica vegetables.
Ascorbigen is an indolyl carbohydrate that consists of (3aS,6S,6aR)-3,3a,6-trihydroxy-3-tetrahydrofuro[3,2-b]furan-2-one in which position 3 is substituted by an indol-3-ylmethyl group. Formed from indole-3-carbinol and ascorbic acid in brassica vegetables. It has a role as a metabolite. It derives from a L-ascorbic acid.
Computed Properties
Molecular Weight:305.28
XLogP3:-0.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:305.08993720
Monoisotopic Mass:305.08993720
Topological Polar Surface Area:112
Heavy Atom Count:22
Complexity:487
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes