patulin

patulin




Chemical Formula:
C7H6O4
Molecular Weight:
154.122 Daltons
Monoisotopic Mass:
154.026608681 Daltons
SMILES:
C1(OC(O)C2(=CC(=O)OC(=C1)2))
InChI:
1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2
InChIKey:
ZRWPUFFVAOMMNM-UHFFFAOYSA-N

Synonyms
  • (2,4-dihydroxy-2H-pyran-3(6H)-ylidene)acetic acid, 3,4-lactone
  • (2,4-dihydroxy-2H-pyran-3(6H)-ylidene)acetic acid-3,4-lactone
  • 4,6-dihydro-4-hydroxy-2H-furo(3,2-c)pyran-2-one
  • clavacin
  • clavatin
  • claviform
  • claviformin
  • expansin
  • expansine
  • mycoin C3
  • mycoine C3
  • patuline

Databases
MetaCyc:  CPD-16726
MetaboLights:  MTBLC74926
HMDB:  HMDB34299
KEGG:  C16748
ChemSpider:  4534
PubChem (CID):  4696
ChEBI:  74926
Seed:  cpd16547
MetaNetX:  MNXM68985