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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:94201 - LSM-4821
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ChEBI Ontology
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ChEBI Name
LSM-4821
ChEBI ID
CHEBI:94201
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C37H43N3O10
Net Charge
0
Average Mass
689.753
Monoisotopic Mass
689.29484
InChI
InChI=1S/C37H43N3O10/c1-
38(18-
20-
49-
36-
28(45-
2)
22-
26(23-
29(36)
46-
3)
12-
14-
34(43)
39-
16-
8-
6-
10-
32(39)
41)
19-
21-
50-
37-
30(47-
4)
24-
27(25-
31(37)
48-
5)
13-
15-
35(44)
40-
17-
9-
7-
11-
33(40)
42/h6-
7,10-
15,22-
25H,8-
9,16-
21H2,1-
5H3
InChIKey
RTMCABLCJUSQFP-UHFFFAOYSA-N
SMILES
CN(CCOC1=C(C=C(C=C1OC)C=CC(=O)N2CCC=CC2=O)OC)CCOC3=C(C=C(C=C3OC)C=CC(=O)N4CCC=CC4=O)OC
ChEBI Ontology
Outgoing
LSM-4821 (
CHEBI:94201
)
has functional parent
cinnamic acid (
CHEBI:27386
)
LSM-4821 (
CHEBI:94201
)
is a
olefinic compound (
CHEBI:78840
)
Manual Xref
Database
LSM-4821
LINCS
View more database links