Secondary metabolite:3-Methyl-4-propyl-2,5-furandione



EOCID000620
Summary

sCentInDB Chemical identifier: EOCID000620

Chemical name: 3-Methyl-4-propyl-2,5-furandione

Molecular formula: C8H10O3

SMILES: CCCC1=C(C)C(=O)OC1=O

InChI: InChI=1S/C8H10O3/c1-3-4-6-5(2)7(9)11-8(6)10/h3-4H2,1-2H3

InChIKey: YYKCBSMIPLOYJP-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Organoheterocyclic compounds

Class: Dihydrofurans

Subclass: Furanones


Synonymous chemical name(s):
3-methyl-4-propyl-2,5-furandion


External chemical identifier(s):
CHEMBL2270565, CHEMSPIDER:505011, ZINC000098085064, SURECHEMBL:SCHEMBL15268000


Spectrabase ID:
1mg0pn1tnOu


Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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