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CAS 218963-76-9

:

Pelargonidin 3-O-[6-O-(E)-P-coumarin-2-O-β-D-glucoside}-β-D-glucoside]-5-O-(6-O-malonyl）-β-D-glucoside

Fórmula:C45H49O25
InChI:InChI=1S/C45H48O25/c46-15-27-33(54)36(57)40(61)44(67-27)70-42-38(59)35(56)29(16-62-31(52)10-3-18-1-6-20(47)7-2-18)69-45(42)66-26-13-23-24(64-41(26)19-4-8-21(48)9-5-19)11-22(49)12-25(23)65-43-39(60)37(58)34(55)28(68-43)17-63-32(53)14-30(50)51/h1-13,27-29,33-40,42-46,54-61H,14-17H2,(H3-,47,48,49,50,51,52)/p+1/t27-,28-,29-,33-,34-,35-,36+,37+,38+,39-,40-,42-,43-,44+,45-/m1/s1
Clave InChI:MEMCAMOQDXSLTL-MKSLPENWSA-O
SMILES:C1=CC(=CC=C1/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)COC(=O)CC(=O)O)O)O)O)O)C6=CC=C(C=C6)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O
Sinónimos:
  • pelargonidin-3-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl-2-O-β-D-glucopyranosyl]-β-D-glucopyranosyl]-5-[6-O-(2-carboxyacetyl)]-β-D-glucopyranosyl
  • Pelargonidin 3-O-[6-O-(E)-P-coumarin-2-O-β-D-glucoside}-β-D-glucoside]-5-O-(6-O-malonyl）-β-D-glucoside
  • Pelargonidin 3-O-6-O-(E)-P-coumarin-2-O-glucoside}-glucoside]-5-O-(6-O-malonyl)-glucoside chloride
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Pureza (%)
0
100
|
0
|
50
|
90
|
95
|
100
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