Products 76947-60-9

CAS 76947-60-9 is the registry number for Onitin 2'-O-glucoside. Offered by: Biosynth, MedChemExpress. Available pack sizes: 1mg, Get quote.

Onitin 2'-O-glucoside
Biosynth, MedChemExpress
  • size: 1mg, Get quote
  • Variants: 2
View product
Structural formula: {0} (CAS {1})

4-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one (CAS 76947-60-9) is a chemical compound with the molecular formula C21H30O8 and a molecular weight of 410.5 g/mol. IUPAC name: 4-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one. InChIKey: IXDYXCFZRYXQBB-JQAJVKEVSA-N.

Identity
Molecular formulaC21H30O8
Molecular weight410.5 g/mol
IUPAC name4-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one
InChIKeyIXDYXCFZRYXQBB-JQAJVKEVSA-N
SMILESCC1=C(C(=C(C2=C1C(=O)C(C2)(C)C)O)C)CCO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

Computed by PubChem (NCBI)

Synonyms: Onitin 2'-O-glucoside, Onitin2'-O-glucoside, orb1681386, Onitin-15-O-beta-D-glucopyranoside
Isomers (same molecular formula)
(3R)-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3H-inden-1-one C21H30O8
(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one C21H30O8
(12-acetyloxy-1-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradecan-9-yl) 2-methylpropanoate C21H30O8
(2S)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3H-inden-1-one C21H30O8
(E,2S,9E)-2,9-dihydroxy-2-[(1R,2S)-1-hydroxy-2-methylbutyl]-9-[(6R)-6-methyl-2,4-dioxooxan-3-ylidene]-6-methylidenenon-3-enoic acid C21H30O8
(2S)-2-(hydroxymethyl)-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one C21H30O8