biscognienyne B (CHEBI:167050)

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ChEBI Name	biscognienyne B

ChEBI ID	CHEBI:167050

Definition	A member of the class of epoxides that is (1R,6S)-7-oxabicyclo[4.1.0]hept-3-ene substituted by 3-methylbut-2-en-1-yl, hydroxy, 2-methylbut-1-en-3-yn-4-yl, and hydroxy groups at positions 1, 2R, 3 and 5R. It is a meroterpenoid natural product synthesized by the Ascomycota fungus Biscogniauxia sp.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Martin Larralde

Supplier Information

Download	Molfile XML SDF

Formula

C16H20O3

Net Charge

Average Mass

260.333

Monoisotopic Mass

260.14124

InChI

InChI=1S/C16H20O3/c1-10(2)5-6-12-9-13(17)15-16(19-15,14(12)18)8-7-11(3)4/h7,9,13-15,17-18H,1,8H2,2-4H3/t13-,14-,15+,16-/m1/s1

InChIKey

UAAPCPSYCUMTPM-LVQVYYBASA-N

SMILES

CC(C)=CC[C@]12O[C@H]1[C@H](O)C=C(C#CC(C)=C)[C@H]2O

Metabolite of Species	Details
Biscogniauxia sp. (NCBI:txid1896107)	GenBank: MT109335.1 of strain 71-10-1-1 See: PubMed

Roles Classification
Biological Role(s):	fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via meroterpenoid )

ChEBI Ontology
Outgoing	biscognienyne B (CHEBI:167050) has role fungal metabolite (CHEBI:76946) biscognienyne B (CHEBI:167050) is a acetylenic compound (CHEBI:73474) biscognienyne B (CHEBI:167050) is a diol (CHEBI:23824) biscognienyne B (CHEBI:167050) is a epoxide (CHEBI:32955) biscognienyne B (CHEBI:167050) is a meroterpenoid (CHEBI:64419) biscognienyne B (CHEBI:167050) is a olefinic compound (CHEBI:78840) biscognienyne B (CHEBI:167050) is a secondary alcohol (CHEBI:35681) biscognienyne B (CHEBI:167050) is a secondary allylic alcohol (CHEBI:134396)

IUPAC Name

(1R,2R,5R,6S)-1-(3-methylbut-2-en-1-yl)-3-(3-methylbut-3-en-1-yn-1-yl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol

Citation	Type	Source
32364293	PubMed citation	SUBMITTER

Last Modified

27 April 2021