3-farnesyl-3-hydroxy-2-methyl-1-oxo-1lambda(5)-quinolin-4-one (CHEBI:90890)

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CHEBI:90890 - 3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one

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ChEBI ID	CHEBI:90890
ChEBI Name	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one
Stars
ASCII Name	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1lambda(5)-quinolin-4-one
Definition	A member of the class of quinoline N-oxides that is 3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one carrying an additional (2E,6E)-farnesyl group at position 3.
Last Modified	6 February 2018
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C25H33NO3
Net Charge	0
Average Mass	395.543
Monoisotopic Mass	395.24604
SMILES	CC(C)=CCC/C(C)=C/CC/C(C)=C/CC1(O)C(=O)c2ccccc2[N+]([O-])=C1C
InChI	InChI=1S/C25H33NO3/c1-18(2)10-8-11-19(3)12-9-13-20(4)16-17-25(28)21(5)26(29)23-15-7-6-14-22(23)24(25)27/h6-7,10,12,14-16,28H,8-9,11,13,17H2,1-5H3/b19-12+,20-16+
InChIKey	HZBJGDKEAJESLM-YEFHWUCQSA-N

Species of Metabolite	Component	Source	Comments
Stigmatella aurantiaca Sg a15 (ncbitaxon:675526)	-	PubMed (22907798)	Strain: Sg a15

Roles Classification

Biological Role:

bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

ChEBI Ontology

Outgoing Relation(s)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) has role bacterial metabolite (CHEBI:76969)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) is a olefinic compound (CHEBI:78840)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) is a quinoline N-oxide (CHEBI:26508)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) is a quinolone (CHEBI:23765)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) is a tertiary alcohol (CHEBI:26878)
	3-farnesyl-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one (CHEBI:90890) is a tertiary α-hydroxy ketone (CHEBI:139592)

IUPAC Name
3-hydroxy-2-methyl-1-oxo-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-1λ⁵-quinolin-4(3H)-one

Synonyms	Source
[(2E,6E)-farnesyl]-3-hydroxy-2-methyl-1-oxo-1λ⁵-quinolin-4-one	ChEBI
4-hydroxy-2-methyl-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]quinolin-3(4H)-one 1-oxide	MetaCyc

UniProt Name	Source
2-hydroxy-1a-methyl-7a-[(2E,6E)-farnesyl]-1a,2-dihydrooxireno[2,3-b]quinolin-7(7aH)-one	UniProt

Manual Xrefs	Databases
CPD-18762	MetaCyc

Citations