Oblongolide N (CHEBI:217608)

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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	Oblongolide N

ChEBI ID	CHEBI:217608

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H20O4

Net Charge

Average Mass

252.310

Monoisotopic Mass

252.13616

InChI

InChI=1S/C14H20O4/c1-8-5-9-3-4-14(17)7-18-12(16)13(14,2)10(9)6-11(8)15/h3-4,8-11,15,17H,5-7H2,1-2H3/t8-,9+,10+,11-,13+,14+/m1/s1

InChIKey

JERURDSCJJKNSY-BYYLKJONSA-N

SMILES

O=C1OC[C@@]2([C@]1([C@@H]3[C@H](C[C@@H](C)[C@@H](C3)O)C=C2)C)O

Metabolite of Species	Details
Phomopsisspecies XZ-26 (NCBI:txid357842)	See: DOI

ChEBI Ontology
Outgoing	Oblongolide N (CHEBI:217608) is a naphthofuran (CHEBI:39270)

IUPAC Name

(3aR,5aR,7R,8R,9aS,9bR)-3a,8-dihydroxy-7,9b-dimethyl-5a,6,7,8,9,9a-hexahydro-3H-benzo[g][2]benzouran-1-one