CHEBI:207177 - Penazaphilone C

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ChEBI Name Penazaphilone C
ChEBI ID CHEBI:207177
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H28ClNO6
Net Charge 0
Average Mass 449.930
Monoisotopic Mass 449.16052
InChI InChI=1S/C23H28ClNO6/c1-13(10-14(2)15(3)27)6-7-17-11-18-19(12-25(17)8-9-26)21(29)23(5,31-16(4)28)22(30)20(18)24/h6-7,10-12,14-15,26-27H,8-9H2,1-5H3/t14-,15-,23+/m1/s1
InChIKey DEJPZRICRUJCQX-WBPRFABPSA-N
SMILES ClC1=C2C(C(=O)[C@@](C1=O)(OC(=O)C)C)=CN(CCO)C(=C2)C=CC(=C[C@H]([C@H](O)C)C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
(via azaphilone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Penazaphilone C (CHEBI:207177) is a azaphilone (CHEBI:50941)
IUPAC Name
[(7S)-5-chloro-3-[(5R,6R)-6-hydroxy-3,5-dimethylhepta-1,3-dienyl]-2-(2-hydroxyethyl)-7-methyl-6,8-dioxoisoquinolin-7-yl] acetate