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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:101895 - LSM-13256
Main
ChEBI Ontology
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ChEBI Name
LSM-13256
ChEBI ID
CHEBI:101895
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C28H39N3O4
Net Charge
0
Average Mass
481.628
Monoisotopic Mass
481.29406
InChI
InChI=1S/C28H39N3O4/c1-
20-
16-
31(21(2)
18-
32)
28(34)
25-
13-
9-
8-
12-
24(25)
23-
11-
7-
6-
10-
22(23)
19-
35-
26(20)
17-
30(5)
27(33)
14-
15-
29(3)
4/h6-
13,20-
21,26,32H,14-
19H2,1-
5H3/t20-
,21+,26-
/m1/s1
InChIKey
IEBNCDQMHLDDBS-YZIHRLCOSA-N
SMILES
C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)CCN(C)C)[C@@H](C)CO
ChEBI Ontology
Outgoing
LSM-13256 (
CHEBI:101895
)
has functional parent
β-amino acid (
CHEBI:33706
)
LSM-13256 (
CHEBI:101895
)
is a
organonitrogen compound (
CHEBI:35352
)
LSM-13256 (
CHEBI:101895
)
is a
organooxygen compound (
CHEBI:36963
)
Manual Xref
Database
LSM-13256
LINCS
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