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Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
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ChEBI
> Main
CHEBI:103242 - LSM-14586
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ChEBI Ontology
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ChEBI Name
LSM-14586
ChEBI ID
CHEBI:103242
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C23H25N3O5
Net Charge
0
Average Mass
423.463
Monoisotopic Mass
423.17942
InChI
InChI=1S/C23H25N3O5/c1-
2-
3-
14-
5-
6-
17-
21-
20(15(11-
27)
16(25-
21)
10-
26(17)
23(14)
29)
22(28)
24-
9-
13-
4-
7-
18-
19(8-
13)
31-
12-
30-
18/h2-
8,15-
16,20-
21,25,27H,9-
12H2,1H3,(H,24,28)
/t15-
,16-
,20+,21+/m0/s1
InChIKey
ZLAIHPPUWVVFMW-LVNJIZSUSA-N
SMILES
CC=CC1=CC=C2[C@@H]3[C@@H]([C@H]([C@@H](N3)CN2C1=O)CO)C(=O)NCC4=CC5=C(C=C4)OCO5
ChEBI Ontology
Outgoing
LSM-14586 (
CHEBI:103242
)
has functional parent
β-amino acid (
CHEBI:33706
)
LSM-14586 (
CHEBI:103242
)
is a
organonitrogen compound (
CHEBI:35352
)
LSM-14586 (
CHEBI:103242
)
is a
organooxygen compound (
CHEBI:36963
)
Manual Xref
Database
LSM-14586
LINCS
View more database links