xylarenone A, (rel)- (CHEBI:69731)

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ChEBI Name	xylarenone A, (rel)-

ChEBI ID	CHEBI:69731

Definition	A natural product found in Endophytic fungi and Xylaria species.

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

Supplier Information

Download	Molfile XML SDF

Formula

C15H20O4

Net Charge

Average Mass

264.31690

Monoisotopic Mass

264.13616

InChI

InChI=1S/C15H20O4/c1-8-4-5-11(17)10-6-12(18)15(9(2)7-16)13(19-15)14(8,10)3/h6,8,11,13,16-17H,2,4-5,7H2,1,3H3/t8-,11+,13+,14+,15-/m0/s1

InChIKey

PSGJCHLXOJTCGB-SXHPEXCUSA-N

SMILES

[H][C@]12O[C@@]1(C(=C)CO)C(=O)C=C1[C@H](O)CC[C@H](C)[C@@]21C

Metabolite of Species	Details
Xylaria (NCBI:txid37991)	of strain NCY2 See: PubMed
Endophytic fungi (NCBI:txid4751)	Methanolic extract of Camarops like Endophytic fungus isolated from leaves of Alibertia macrophylla of strain AM 02 See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	xylarenone A, (rel)- (CHEBI:69731) has role metabolite (CHEBI:25212) xylarenone A, (rel)- (CHEBI:69731) is a sesquiterpenoid (CHEBI:26658)

Synonym	Source
rel-(1aR,4R,7S,7aR,7bR)-4-Hydroxy-1a-(3-hydroxy-1-propen-2-yl)-7,7a-dimethyl-4,5,6,7,7a,7b-hexahydronaphtho[1,2-b]oxiren-2(1aH)-one	ChEBI

Citation	Type	Source
21510613	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:ketone(CHEBI:17087); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:epoxide(CHEBI:32955); ISA:ether(CHEBI:25698); ISA:primary alcohol(CHEBI:15734);