Products 2089462-18-8

CAS 2089462-18-8 is the registry number for 3-[[6-O-(2-Carboxyacetyl)-β-D-glucopyranosyl]oxy]-2-[4-(β-D-glucopyranosyloxy)phenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one, ≥95%. Offered by: Chemat. Available pack sizes: 20mg, 50mg, 100mg.

3-[[6-O-(2-Carboxyacetyl)-β-D-glucopyranosyl]oxy]-2-[4-(β-D-glucopyranosyloxy)phenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one, ≥95%
Chemat
  • size: 20mg, 50mg, 100mg
  • Variants: 3
from 1912.40
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Structural formula: {0} (CAS {1})

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-7-methoxy-4-oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-3-yl]oxyoxan-2-yl]methoxy]propanoic acid (CAS 2089462-18-8) is a chemical compound with the molecular formula C31H34O19 and a molecular weight of 710.6 g/mol. IUPAC name: 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-7-methoxy-4-oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-3-yl]oxyoxan-2-yl]methoxy]propanoic acid. InChIKey: LYXGNVPOKGCBIY-BJQVKHFCSA-N.

Identity
Molecular formulaC31H34O19
Molecular weight710.6 g/mol
IUPAC name3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-7-methoxy-4-oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-3-yl]oxyoxan-2-yl]methoxy]propanoic acid
InChIKeyLYXGNVPOKGCBIY-BJQVKHFCSA-N
SMILESCOC1=CC(=C2C(=C1)OC(=C(C2=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)CC(=O)O)O)O)O)C4=CC=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

Computed by PubChem (NCBI)