Products 176665-78-4

CAS 176665-78-4 appears in our catalog under these names: Ducheside A, Ducheside A, ≥98%. Offered by: Biosynth, MedChemExpress, Chemat. Available pack sizes: 10mg, 1mg, 2mg, 5mg, 25mg, Get quote.

Ducheside A
Biosynth, MedChemExpress
  • size: 10mg, 1mg, 2mg, 5mg
  • Variants: 6
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Ducheside A, ≥98%
Chemat
  • size: 5mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

6,14-dihydroxy-7-methoxy-13-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione (CAS 176665-78-4) is a chemical compound with the molecular formula C20H16O12 and a molecular weight of 448.3 g/mol. IUPAC name: 6,14-dihydroxy-7-methoxy-13-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione. InChIKey: VAXNJGHUQUHOGC-ZDLAQBPYSA-N.

Identity
Molecular formulaC20H16O12
Molecular weight448.3 g/mol
IUPAC name6,14-dihydroxy-7-methoxy-13-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
InChIKeyVAXNJGHUQUHOGC-ZDLAQBPYSA-N
SMILESCOC1=C(C=C2C3=C1OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Ducheside A, orb1682718, 3'-O-methyl-4-O-(beta-D-xylopyranosyl) ellagic acid
Isomers (same molecular formula)
6,7,13-trihydroxy-14-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C20H16O12
6,7,14-trihydroxy-13-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C20H16O12