4H-Pyran-4-one, 3-[[5-acetyl-2,3-dihydro-4,6-dihydroxy-2-(1-methylethenyl)-7-benzofuranyl]methyl]-6-ethyl-2-hydroxy-5-methyl-

CAS Registry Number®

75680-21-6
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CAS Name

4H-Pyran-4-one, 3-[[5-acetyl-2,3-dihydro-4,6-dihydroxy-2-(1-methylethenyl)-7-benzofuranyl]methyl]-6-ethyl-2-hydroxy-5-methyl-

Molecular Formula

C22H24O7

Molecular Mass

400.42

Cite this Page

4H-Pyran-4-one, 3-[[5-acetyl-2,3-dihydro-4,6-dihydroxy-2-(1-methylethenyl)-7-benzofuranyl]methyl]-6-ethyl-2-hydroxy-5-methyl-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=75680-21-6 (retrieved 2024-09-21) (CAS RN: 75680-21-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H24O7/c1-6-15-10(4)18(24)14(22(27)29-15)7-12-19(25)17(11(5)23)20(26)13-8-16(9(2)3)28-21(12)13/h16,25-27H,2,6-8H2,1,3-5H3

InChIKey

InChIKey=KSYXICOARFSMFI-UHFFFAOYSA-N

SMILES

C(C1=C2C(=C(O)C(C(C)=O)=C1O)CC(C(C)=C)O2)C=3C(=O)C(C)=C(CC)OC3O

Canonical SMILES

O=C1C(=C(OC(O)=C1CC2=C(O)C(=C(O)C3=C2OC(C(=C)C)C3)C(=O)C)CC)C

Other Names for this Substance

  • 4H-Pyran-4-one, 3-[[5-acetyl-2,3-dihydro-4,6-dihydroxy-2-(1-methylethenyl)-7-benzofuranyl]methyl]-6-ethyl-2-hydroxy-5-methyl-
  • Italipyrone