Products 16727-02-9

CAS 16727-02-9 appears in our catalog under these names: Cyanidin 3–sophoroside–5–glucoside, Cyanidin 3-sophoroside-5-glucoside. Offered by: GLPBio, MedChemExpress. Available pack sizes: 1mg, 5mg, 5 mg, 1 mg.

Cyanidin 3–sophoroside–5–glucoside
GLPBio
  • size: 1mg, 5mg
  • Variants: 2
from 2015.23
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Cyanidin 3-sophoroside-5-glucoside
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 1945.09
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Structural formula: {0} (CAS {1})

(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chloride (CAS 16727-02-9) is a chemical compound with the molecular formula C33H41ClO21 and a molecular weight of 809.1 g/mol. IUPAC name: (2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chloride. InChIKey: KUIBYMKXRAGBBM-OOGSEBJWSA-N.

Identity
Molecular formulaC33H41ClO21
Molecular weight809.1 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chloride
InChIKeyKUIBYMKXRAGBBM-OOGSEBJWSA-N
SMILESC1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O.[Cl-]

Computed by PubChem (NCBI)

Synonyms: orb1942122