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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:101706 - LSM-13069
Main
ChEBI Ontology
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ChEBI Name
LSM-13069
ChEBI ID
CHEBI:101706
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C17H20N2O5
Net Charge
0
Average Mass
332.352
Monoisotopic Mass
332.13722
InChI
InChI=1S/C17H20N2O5/c1-
24-
17(23)
14-
10(8-
20)
12-
7-
18-
11(3-
2-
4-
13(18)
21)
15(14)
19(12)
16(22)
9-
5-
6-
9/h2-
4,9-
10,12,14-
15,20H,5-
8H2,1H3/t10-
,12-
,14+,15+/m0/s1
InChIKey
KUBNHDDGXKERLH-OBCWZRDOSA-N
SMILES
COC(=O)[C@@H]1[C@H]([C@@H]2CN3C(=O)C=CC=C3[C@H]1N2C(=O)C4CC4)CO
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
LSM-13069 (
CHEBI:101706
)
is a
carboxylic acid (
CHEBI:33575
)
LSM-13069 (
CHEBI:101706
)
is a
pyrrolidinecarboxylic acid (
CHEBI:46767
)
Manual Xref
Database
LSM-13069
LINCS
View more database links