CHEBI:107200 - LSM-18554

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ChEBI Name LSM-18554
ChEBI ID CHEBI:107200
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H18N5
Net Charge +1
Average Mass 268.337
Monoisotopic Mass 268.15567
InChI InChI=1S/C15H17N5/c1-3-11-5-7-12(8-6-11)20(4-2)15-13-14(17-9-16-13)18-10-19-15/h5-10H,3-4H2,1-2H3,(H,16,17,18,19)/p+1
InChIKey ORQLFPFMAQXHPJ-UHFFFAOYSA-O
SMILES CCC1=CC=C(C=C1)N(CC)C2=[NH+]C=NC3=C2NC=N3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing LSM-18554 (CHEBI:107200) is a aromatic amine (CHEBI:33860)
LSM-18554 (CHEBI:107200) is a tertiary amino compound (CHEBI:50996)
Manual Xref Database
LSM-18554 LINCS
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