Neovasifuranone B (CHEBI:211417)

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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	Neovasifuranone B

ChEBI ID	CHEBI:211417

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H26O4

Net Charge

Average Mass

282.380

Monoisotopic Mass

282.18311

InChI

InChI=1S/C16H26O4/c1-6-10(3)14(18)11(4)8-16(5)15(19)12(9-17)13(7-2)20-16/h8,10,14,17-18H,6-7,9H2,1-5H3/b11-8+/t10-,14-,16-/m0/s1

InChIKey

SMULVQLXQOAZLH-QKVBFUPUSA-N

SMILES

O=C1C(=C(CC)O[C@]1(/C=C(/[C@@H](O)[C@H](CC)C)\C)C)CO

Metabolite of Species	Details
Fusarium neocosmosporiellum (NCBI:txid1325723)	See: DOI

ChEBI Ontology
Outgoing	Neovasifuranone B (CHEBI:211417) is a oxolanes (CHEBI:26912)

IUPAC Name

(2S)-5-ethyl-2-[(E,3S,4S)-3-hydroxy-2,4-dimethylhex-1-enyl]-4-(hydroxymethyl)-2-methyluran-3-one