CHEBI:207604 - Penicisoquinoline

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Penicisoquinoline
ChEBI ID CHEBI:207604
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H15NO4
Net Charge 0
Average Mass 273.288
Monoisotopic Mass 273.10011
InChI InChI=1S/C15H15NO4/c1-8(2)15(19)14(18)11-4-3-9-5-10(7-17)16-6-12(9)13(11)20-15/h3-6,8,17,19H,7H2,1-2H3/t15-/m0/s1
InChIKey KQLMNYPZKDINDZ-HNNXBMFYSA-N
SMILES O=C1C2=C(C=3C(=CC(CO)=NC3)C=C2)O[C@@]1(O)C(C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: DOI
ChEBI Ontology
Outgoing Penicisoquinoline (CHEBI:207604) is a isoquinolines (CHEBI:24922)
IUPAC Name
2-hydroxy-7-(hydroxymethyl)-2-propan-2-yluro[3,2-h]isoquinolin-3-one
Manual Xref Database
27024872 ChemSpider
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