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ChEBI
> Main
CHEBI:18146 - (
R
)-canadine
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ChEBI Name
(
R
)-canadine
ChEBI ID
CHEBI:18146
ChEBI ASCII Name
(R)-canadine
Definition
A canadine which has
R
configuration.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:10998, CHEBI:337
Supplier Information
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Formula
C20H21NO4
Net Charge
0
Average Mass
339.38500
Monoisotopic Mass
339.14706
InChI
InChI=1S/C20H21NO4/c1-
22-
17-
4-
3-
12-
7-
16-
14-
9-
19-
18(24-
11-
25-
19)
8-
13(14)
5-
6-
21(16)
10-
15(12)
20(17)
23-
2/h3-
4,8-
9,16H,5-
7,10-
11H2,1-
2H3/t16-
/m1/s1
InChIKey
VZTUIEROBZXUFA-MRXNPFEDSA-N
SMILES
[H][C@]12Cc3ccc(OC)c(OC)c3CN1CCc1cc3OCOc3cc21
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.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(
R
)-canadine (
CHEBI:18146
)
is a
canadine (
CHEBI:22998
)
(
R
)-canadine (
CHEBI:18146
)
is enantiomer of
(
S
)-canadine (
CHEBI:16592
)
Incoming
(
S
)-canadine (
CHEBI:16592
)
is enantiomer of
(
R
)-canadine (
CHEBI:18146
)
IUPAC Name
(13a
R
)-
9,10-
dimethoxy-
5,8,13,13a-
tetrahydro-
6
H
-
[1,3]dioxolo[4,5-
g
]isoquino[3,2-
a
]isoquinoline
Synonyms
Sources
(R)-Canadine
KEGG COMPOUND
(
R
)-canadine
UniProt
Manual Xref
Database
C11818
KEGG COMPOUND
View more database links
Registry Number
Type
Source
96685
Beilstein Registry Number
Beilstein
Last Modified
13 November 2017