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CHEBI:68923 - bruceolline L
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ChEBI Name
bruceolline L
ChEBI ID
CHEBI:68923
Definition
An indole alkaloid that is 1
H
-indole substituted by a (2
R
)-2-hydroxy-3-methylbutanoyl group at position 3. It has been isolated from the ethanol extract of the stems of
Brucea mollis
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H15NO2
Net Charge
0
Average Mass
217.26370
Monoisotopic Mass
217.11028
InChI
InChI=1S/C13H15NO2/c1-8(2)12(15)13(16)10-7-14-11-6-4-3-5-9(10)11/h3-8,12,14-15H,1-2H3/t12-/m1/s1
InChIKey
WSNIHKDHYATUSE-GFCCVEGCSA-N
SMILES
CC(C)[C@@H](O)C(=O)c1c[nH]c2ccccc12
Metabolite of Species
Details
Brucea mollis
(NCBI:txid43723)
Found in stem
(BTO:0001300)
. Ethanolic extract of air-dried and powdered stems See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
bruceolline L (
CHEBI:68923
)
has role
plant metabolite (
CHEBI:76924
)
bruceolline L (
CHEBI:68923
)
is a
aromatic ketone (
CHEBI:76224
)
bruceolline L (
CHEBI:68923
)
is a
indole alkaloid (
CHEBI:38958
)
bruceolline L (
CHEBI:68923
)
is a
secondary α-hydroxy ketone (
CHEBI:2468
)
bruceolline L (
CHEBI:68923
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
(2
R
)-2-hydroxy-1-(1
H
-indol-3-yl)-3-methylbutan-1-one
Registry Number
Type
Source
22123606
Reaxys Registry Number
Reaxys
Citation
Type
Source
22070654
PubMed citation
Europe PMC
Last Modified
06 February 2018