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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:29091 - nocardicin E
Main
ChEBI Ontology
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ChEBI Name
nocardicin E
ChEBI ID
CHEBI:29091
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:14663, CHEBI:25571
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Formula
C19H17N3O7
Net Charge
0
Average Mass
399.35430
Monoisotopic Mass
399.10665
InChI
InChI=1S/C19H17N3O7/c23-
12-
5-
1-
10(2-
6-
12)
15(21-
29)
17(25)
20-
14-
9-
22(18(14)
26)
16(19(27)
28)
11-
3-
7-
13(24)
8-
4-
11/h1-
8,14,16,23-
24,29H,9H2,(H,20,25)
(H,27,28)
/b21-
15-
/t14-
,16+/m0/s1
InChIKey
NMMOYDKOFASOBV-HKHZIIAMSA-N
SMILES
O\N=C(/C(=O)N[C@H]1CN([C@@H](C(O)=O)c2ccc(O)cc2)C1=O)c1ccc(O)cc1
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via
heterocyclic antibiotic
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
nocardicin E (
CHEBI:29091
)
is a
monocarboxylic acid (
CHEBI:25384
)
nocardicin E (
CHEBI:29091
)
is a
nocardicin (
CHEBI:25572
)
nocardicin E (
CHEBI:29091
)
is conjugate acid of
nocardicin E(1−) (
CHEBI:58610
)
Incoming
nocardicin E(1−) (
CHEBI:58610
)
is conjugate base of
nocardicin E (
CHEBI:29091
)
IUPAC Name
(2
R
)-
{(3
S
)-
3-
[(2
Z
)-
2-
(hydroxyimino)-
2-
(4-
hydroxyphenyl)acetamido]-
2-
oxoazetidin-
1-
yl}(4-
hydroxyphenyl)acetic acid
Manual Xref
Database
C01739
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
3598528
Beilstein Registry Number
Beilstein
63555-59-9
CAS Registry Number
ChemIDplus
Last Modified
28 July 2014