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Home > Encyclopedia > [1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate

[1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate

[1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate structure

[1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate 

structure
  • CAS No:

    133806-61-8

  • Formula:

    C23H24O7

  • Chemical Name:

    [1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate

  • Synonyms:

    5-1''-acetoxy-6'-formyl-4-methoxy-4'-methyl-3''-methylbutyl-spiro(benzofuran-2,1'-cyclohexa-3',5'-diene)-2',3(2H)-dione;purpactin C;Purpactin C;133806-61-8;DTXSID50928280;FO-608C;[1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate;5-1''-Acetoxy-6'-formyl-4-methoxy-4'-methyl-3''-methylbutyl-spiro(benzofuran-2,1'-cyclohexa-3',5'-diene)-2',3(2H)-dione;1-(2'-Formyl-4-methoxy-4'-methyl-3,6'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,4]dien]-5-yl)-3-methylbutyl acetate;Spiro(benzofuran-2(3H),1'-(2,4)cyclohexadiene)-3,6'-dione, 5-(1-(acetyloxy)-3-methylbutyl)-2'-formyl-4-methoxy-4'-methyl-

[1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate Basic Attributes

412.4 g/mol

412.15220310 g/mol

Characteristics

96 Ų

Drug Information

5-1''-acetoxy-6'-formyl-4-methoxy-4'-methyl-3''-methylbutyl-spiro(benzofuran-2,1'-cyclohexa-3',5'-diene)-2',3(2H)-dione

Computed Properties

Molecular Weight:412.4
XLogP3:2.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:412.15220310
Monoisotopic Mass:412.15220310
Topological Polar Surface Area:96
Heavy Atom Count:30
Complexity:808
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [1-(1'-formyl-4-methoxy-3'-methyl-3,5'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,3-diene]-5-yl)-3-methylbutyl] acetate

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