Products 1033721-36-6

CAS 1033721-36-6 is the registry number for (4S)-4-[[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]methyl]-3,5,5-trimethyl-2-cyclohexen-1-one, ≥95%. Offered by: Chemat. Available pack sizes: 20mg.

(4S)-4-[[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]methyl]-3,5,5-trimethyl-2-cyclohexen-1-one, ≥95%
Chemat
  • size: 20mg
  • Variants: 1
from 7451.60
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Structural formula: {0} (CAS {1})

(4S)-3,5,5-trimethyl-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]cyclohex-2-en-1-one (CAS 1033721-36-6) is a chemical compound with the molecular formula C22H36O12 and a molecular weight of 492.5 g/mol. IUPAC name: (4S)-3,5,5-trimethyl-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]cyclohex-2-en-1-one. InChIKey: QZPVSTDMMLQZNZ-QRAPPIIHSA-N.

Identity
Molecular formulaC22H36O12
Molecular weight492.5 g/mol
IUPAC name(4S)-3,5,5-trimethyl-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]cyclohex-2-en-1-one
InChIKeyQZPVSTDMMLQZNZ-QRAPPIIHSA-N
SMILESCC1=CC(=O)CC([C@@H]1CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O)(C)C

Computed by PubChem (NCBI)

Synonyms: Jasminoside H, orb2893558