CHEBI:209080 - Diorcinol M

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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 Diorcinol M
ChEBI ID CHEBI:209080
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H17NO6
Net Charge 0
Average Mass 331.324
Monoisotopic Mass 331.10559
InChI InChI=1S/C17H17NO6/c1-8-4-10(19)6-12(14(8)16(18)21)24-13-7-11(20)5-9(2)15(13)17(22)23-3/h4-7,19-20H,1-3H3,(H2,18,21)
InChIKey NRROXAZVOHCNCT-UHFFFAOYSA-N
SMILES O=C(OC)C1=C(OC2=C(C(=CC(=C2)O)C)C(=O)N)C=C(O)C=C1C
Metabolite of Species Details
Arthrinium (NCBI:txid112177) See: PubMed
ChEBI Ontology
Outgoing Diorcinol M (CHEBI:209080) is a aromatic ether (CHEBI:35618)
IUPAC Names
(3S)-5-(3-hydroxy-5-methylphenoxy)-2,2,7-trimethyl-6-(3-methylbut-2-enyl)-3,4-dihydrochromen-3-ol
methyl 2-(2-carbamoyl-5-hydroxy-3-methylphenoxy)-4-hydroxy-6-methylbenzoate
Manual Xref Database
71048720 ChemSpider
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