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CHEBI:218241 - Asperimide C

ChEBI IDCHEBI:218241
ChEBI NameAsperimide C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H21NO5
Net Charge0
Average Mass379.412
Monoisotopic Mass379.14197
SMILESCC1(C)Oc2ccc(CC3=C(c4ccc(O)cc4)C(=O)NC3=O)cc2C[C@@H]1O
InChIInChI=1S/C22H21NO5/c1-22(2)18(25)11-14-9-12(3-8-17(14)28-22)10-16-19(21(27)23-20(16)26)13-4-6-15(24)7-5-13/h3-9,18,24-25H,10-11H2,1-2H3,(H,23,26,27)/t18-/m0/s1
InChIKeyYHHDGTNLHGFAIJ-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Aspergillus terreus (ncbitaxon:33178) - PubMed (30308231)
ChEBI Ontology
Outgoing Relation(s)
Asperimide C (CHEBI:218241) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
3-[[(3S)-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]methyl]-4-(4-hydroxyphenyl)pyrrole-2,5-dione