Trypethelon-methylether (CHEBI:199771)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	Trypethelon-methylether

ChEBI ID	CHEBI:199771

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H18O4

Net Charge

Average Mass

286.327

Monoisotopic Mass

286.12051

InChI

InChI=1S/C17H18O4/c1-8-6-10(20-5)7-11-12(8)16-13(15(19)14(11)18)17(3,4)9(2)21-16/h6-7,9H,1-5H3/t9-/m0/s1

InChIKey

CCLFCEGGIPRBIN-VIFPVBQESA-N

SMILES

O=C1C(=O)C2=C(O[C@H](C2(C)C)C)C3=C1C=C(OC)C=C3C

Metabolite of Species	Details
Trypethelium eluteriae (NCBI:txid364715)	See: DOI

ChEBI Ontology
Outgoing	Trypethelon-methylether (CHEBI:199771) is a naphthofuran (CHEBI:39270)

IUPAC Name

7-methoxy-2,3,3,9-tetramethyl-2H-benzo[g][1]benzouran-4,5-dione