Amaranthin
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Amaranthin
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CAS No:
15167-84-7
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Formula:
C30H34N2O19
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Chemical Name:
Amaranthin
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Synonyms:
2,6-Pyridinedicarboxylic acid,4-[2-[(2S)-2-carboxy-5-[(2-O-β-D-glucopyranuronosyl-β-D-glucopyranosyl)oxy]-2,3-dihydro-6-hydroxy-1H-indol-1-yl]ethenyl]-2,3-dihydro-,(2S)-;Amarantin;2,6-Pyridinedicarboxylic acid,4-[2-[2-carboxy-5-[(2-O-β-D-glucopyranuronosyl-β-D-glucopyranosyl)oxy]-2,3-dihydro-6-hydroxy-1H-indol-1-yl]ethenyl]-2,3-dihydro-,[S-(R*,R*)]-;(2S)-4-[2-[(2S)-2-Carboxy-5-[(2-O-β-D-glucopyranuronosyl-β-D-glucopyranosyl)oxy]-2,3-dihydro-6-hydroxy-1H-indol-1-yl]ethenyl]-2,3-dihydro-2,6-pyridinedicarboxylic acid;Amaranthin;Amarantin (plant pigment);11033-33-3;27951-64-0
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CAS No:
Computed Properties
Molecular Weight:726.6
XLogP3:-2.2
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:9
Exact Mass:726.17557686
Monoisotopic Mass:726.17557686
Topological Polar Surface Area:346
Heavy Atom Count:51
Complexity:1450
Undefined Atom Stereocenter Count:12
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes