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ChEBI
> Main
CHEBI:42 - (+)-pronuciferine
Main
ChEBI Ontology
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ChEBI Name
(+)-pronuciferine
ChEBI ID
CHEBI:42
Definition
An isoquinoline alkaloid isolated from
Berberis coletioides
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C19H21NO3
Net Charge
0
Average Mass
311.37498
Monoisotopic Mass
311.15214
InChI
InChI=1S/C19H21NO3/c1-
20-
9-
6-
12-
10-
15(22-
2)
18(23-
3)
17-
16(12)
14(20)
11-
19(17)
7-
4-
13(21)
5-
8-
19/h4-
5,7-
8,10,14H,6,9,11H2,1-
3H3/t14-
/m1/s1
InChIKey
WUYQEGNOQLRQAQ-CQSZACIVSA-N
SMILES
[H][C@]12CC3(C=CC(=O)C=C3)c3c(OC)c(OC)cc(CCN1C)c23
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
(+)-pronuciferine (
CHEBI:42
)
has role
plant metabolite (
CHEBI:76924
)
(+)-pronuciferine (
CHEBI:42
)
is a
aromatic ether (
CHEBI:35618
)
(+)-pronuciferine (
CHEBI:42
)
is a
cyclic ketone (
CHEBI:3992
)
(+)-pronuciferine (
CHEBI:42
)
is a
isoquinoline alkaloid (
CHEBI:24921
)
(+)-pronuciferine (
CHEBI:42
)
is a
isoquinolines (
CHEBI:24922
)
(+)-pronuciferine (
CHEBI:42
)
is a
organic heterotetracyclic compound (
CHEBI:38163
)
IUPAC Name
(8a'
R
)-
5',6'-
dimethoxy-
1'-
methyl-
2',3',8',8a'-
tetrahydro-
1'
H
,4
H
-
spiro[cyclohexa-
2,5-
diene-
1,7'-
cyclopenta[
ij
]isoquinolin]-
4-
one
Synonyms
Sources
Milthanthine
ChemIDplus
N,O-Dimethylcrotonosine
ChemIDplus
N-Methylstepharine
ChemIDplus
Pronuciferin
ChemIDplus
Manual Xrefs
Databases
C00001905
KNApSAcK
C09611
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1549705
Reaxys Registry Number
Reaxys
1549705
Beilstein Registry Number
Beilstein
2128-60-1
CAS Registry Number
KEGG COMPOUND
2128-60-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
19469512
PubMed citation
Europe PMC
5683993
PubMed citation
Europe PMC
Last Modified
22 January 2015