Eremopetasitenin A1 (CHEBI:175667)

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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	Eremopetasitenin A1

ChEBI ID	CHEBI:175667

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H28O6

Net Charge

Average Mass

364.438

Monoisotopic Mass

364.18859

InChI

InChI=1S/C20H28O6/c1-6-10(2)15(22)24-17-18(5)11(3)14(21)8-7-13(18)9-19-20(17,26-19)12(4)16(23)25-19/h6,11-14,17,21H,7-9H2,1-5H3/b10-6+

InChIKey

FYNKIYMILKEXOG-UXBLZVDNSA-N

SMILES

O1C23C1(OC(=O)C2C)CC4C(C3OC(=O)/C(/C)=C/C)(C(C(O)CC4)C)C

ChEBI Ontology
Outgoing	Eremopetasitenin A1 (CHEBI:175667) is a naphthofuran (CHEBI:39270)

IUPAC Name

(5-hydroxy-3,4,13-trimethyl-12-oxo-11,14-dioxatetracyclo[8.3.1.01,10.03,8]tetradecan-2-yl) (E)-2-methylbut-2-enoate