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ChEBI
> Main
CHEBI:69164 - Epimauritine A N-oxide
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ChEBI Name
Epimauritine A N-oxide
ChEBI ID
CHEBI:69164
Definition
A natural product found in
Ziziphus apetala
.
Stars
This entity has been manually annotated by a third party.
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Formula
C32H41N5O6
Net Charge
0
Average Mass
591.69780
Monoisotopic Mass
591.30568
InChI
InChI=1S/C32H41N5O6/c1-
20(2)
27(35-
29(38)
21(3)
37(4,5)
42)
32(41)
36-
18-
16-
26-
28(36)
31(40)
34-
25(19-
23-
9-
7-
6-
8-
10-
23)
30(39)
33-
17-
15-
22-
11-
13-
24(43-
26)
14-
12-
22/h6-
15,17,20-
21,25-
28H,16,18-
19H2,1-
5H3,(H,33,39)
(H,34,40)
(H,35,38)
/b17-
15-
/t21-
,25+,26+,27+,28+/m1/s1
InChIKey
MWQUPAZWQQWEPK-FADZAQNWSA-N
SMILES
[H]
[C@]
12CCN(C(=O)
[C@@H]
(NC(=O)
[C@@H]
(C)
[N+]
(C)
(C)
[O-
]
)
C(C)
C)
[C@]
1([H]
)
C(=O)
N[C@@H]
(Cc1ccccc1)
C(=O)
N\C=C/c1ccc(O2)
cc1
Metabolite of Species
Details
Ziziphus apetala
(NCBI:txid478035)
Found in stem
(BTO:0001300)
. 95% EtOH extract of Air-dried and powdered stems See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Epimauritine A N-oxide (
CHEBI:69164
)
has role
metabolite (
CHEBI:25212
)
Epimauritine A N-oxide (
CHEBI:69164
)
is a
cyclic peptide (
CHEBI:23449
)
Epimauritine A N-oxide (
CHEBI:69164
)
is a
tertiary amine oxide (
CHEBI:134363
)
Citation
Type
Source
22148241
PubMed citation
Europe PMC
Last Modified
01 February 2017
General Comment
2014-10-17
Suggested Classification: ISA:keratan 6'-sulfate(CHEBI:18331); ISA:azamacrocycle(CHEBI:52898); ISA:N-acyl-amino acid(CHEBI:51569); ISA:amino acid amide(CHEBI:22475); ISA:N-acylpyrrolidine(CHEBI:46766); ISA:aromatic ether(CHEBI:35618); ISA:aralkylamine(CHEBI:18000); ISA:fatty amide(CHEBI:29348); ISA:benzenes(CHEBI:22712); ISA:carboxamide(CHEBI:37622); ISA:lactam(CHEBI:24995); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:enamine(CHEBI:47989); ISA:N-oxide(CHEBI:35580); ISA:carbonyl compound(CHEBI:36586); ISA:organic salt(CHEBI:24868); ISA:organic cation(CHEBI:25697);