CHEBI:216417 - Illudinine

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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 Illudinine
ChEBI ID CHEBI:216417
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H17NO3
Net Charge 0
Average Mass 271.316
Monoisotopic Mass 271.12084
InChI InChI=1S/C16H17NO3/c1-16(2)6-10-11(7-16)14(20-3)12-8-17-5-4-9(12)13(10)15(18)19/h4-5,8H,6-7H2,1-3H3,(H,18,19)
InChIKey FSBVQCVHOXXMGN-UHFFFAOYSA-N
SMILES O=C(O)C=1C=2C(C(OC)=C3C1CC(C)(C)C3)=CN=CC2
Metabolite of Species Details
Clitocybe (NCBI:txid50966) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Illudinine (CHEBI:216417) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name
9-methoxy-7,7-dimethyl-6,8-dihydrocyclopenta[g]isoquinoline-5-carboxylic acid
Manual Xref Database
248322 ChemSpider
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