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> Main
CHEBI:132696 - α-colubrine
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ChEBI Ontology
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ChEBI Name
α-colubrine
ChEBI ID
CHEBI:132696
ChEBI ASCII Name
alpha-colubrine
Definition
A monoterpenoid indole alkaloid that is strychnine in which the hydrogen at position 3 has been replaced by a methoxy group. It is a minor alkaloid from
Strychnos nux-vomica
.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
qingping liu
Supplier Information
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Formula
C22H24N2O3
Net Charge
0
Average Mass
364.438
Monoisotopic Mass
364.17869
InChI
InChI=1S/C22H24N2O3/c1-
26-
13-
2-
3-
15-
16(8-
13)
24-
19(25)
10-
17-
20-
14-
9-
18-
22(15,21(20)
24)
5-
6-
23(18)
11-
12(14)
4-
7-
27-
17/h2-
4,8,14,17-
18,20-
21H,5-
7,9-
11H2,1H3/t14-
,17-
,18-
,20-
,21-
,22+/m0/s1
InChIKey
CAPUGADOGHKUQS-JPPAUQSISA-N
SMILES
C1[C@@]
2(N3CC[C@@]
42[C@]
5(N(C=6C4=CC=C(C6)
OC)
C(C[C@]
7([C@@]
5([C@@]
1(C(=CCO7)
C3)
[H]
)
[H]
)
[H]
)
=O)
[H]
)
[H]
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
α-colubrine (
CHEBI:132696
)
has functional parent
strychnine (
CHEBI:28973
)
α-colubrine (
CHEBI:132696
)
has role
plant metabolite (
CHEBI:76924
)
α-colubrine (
CHEBI:132696
)
is a
aromatic ether (
CHEBI:35618
)
α-colubrine (
CHEBI:132696
)
is a
monoterpenoid indole alkaloid (
CHEBI:65323
)
α-colubrine (
CHEBI:132696
)
is a
organic heteroheptacyclic compound (
CHEBI:52157
)
α-colubrine (
CHEBI:132696
)
is conjugate base of
α-colubrine(1+) (
CHEBI:231864
)
Incoming
α-colubrine(1+) (
CHEBI:231864
)
is conjugate acid of
α-colubrine (
CHEBI:132696
)
IUPAC Name
3-methoxystrychnidin-10-one
Synonym
Source
3-methoxystrychnine
ChemIDplus
Manual Xref
Database
C00025153
KNApSAcK
View more database links
Registry Numbers
Types
Sources
509-44-4
CAS Registry Number
ChemIDplus
57558
Reaxys Registry Number
Reaxys
Last Modified
16 August 2016