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Substance Name: Shanorellin
RN: 22631-97-6
InChIKey: ISBZQQHZWPNKOK-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-O4

Molecular Weight

  • 182.174
 
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Names and Synonyms

Name of Substance

  • Shanorellin

Synonym

  • 2,6-Dimethyl-3-hydroxymethyl-5-hydroxy-1,4-benzoquinone

Systematic Name

  • 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-6-(hydroxymethyl)-3,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 22631-97-6

System Generated Number

  • 0022631976

Structure Descriptors

InChI

1S/C9H10O4/c1-4-6(3-10)9(13)8(12)5(2)7(4)11/h10,12H,3H2,1-2H3

InChIKey

ISBZQQHZWPNKOK-UHFFFAOYSA-N

Smiles

CC1=C(C(=O)C(=C(C1=O)C)O)CO