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Substance Name: Purpactin C
RN: 133806-61-8
InChIKey: JFVAWGUDTZFPLP-UHFFFAOYSA-N

Note

  • From Penicillium purpurogenum.

Molecular Formula

  • C23-H24-O7

Molecular Weight

  • 412.436
 
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Names and Synonyms

Name of Substance

  • Purpactin C

Synonym

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

Systematic Name

  • Spiro(benzofuran-2(3H),1'-(2,4)cyclohexadiene)-3,6'-dione, 5-(1-(acetyloxy)-3-methylbutyl)-2'-formyl-4-methoxy-4'-methyl-

Registry Numbers

CAS Registry Number

  • 133806-61-8

System Generated Number

  • 0133806618

Structure Descriptors

InChI

1S/C23H24O7/c1-12(2)8-18(29-14(4)25)16-6-7-17-20(21(16)28-5)22(27)23(30-17)15(11-24)9-13(3)10-19(23)26/h6-7,9-12,18H,8H2,1-5H3

InChIKey

JFVAWGUDTZFPLP-UHFFFAOYSA-N

Smiles

O1[C@@]2(C(c3c1ccc(c3OC)[C@@H](CC(C)C)OC(=O)C)=O)C(=CC(=CC2=O)C)C=O