CHEBI:100257 - LSM-11632

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ChEBI Name LSM-11632
ChEBI ID CHEBI:100257
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H26N4O4
Net Charge 0
Average Mass 422.478
Monoisotopic Mass 422.19541
InChI InChI=1S/C23H26N4O4/c28-14-15-18-13-26-17(8-6-9-19(26)29)21(20(15)23(31)25-11-4-1-5-12-25)27(18)22(30)16-7-2-3-10-24-16/h2-3,6-10,15,18,20-21,28H,1,4-5,11-14H2/t15-,18-,20+,21+/m1/s1
InChIKey NNGWCWYYPXSIHJ-NXXWWENFSA-N
SMILES C1CCN(CC1)C(=O)[C@H]2[C@@H]([C@H]3CN4C(=O)C=CC=C4[C@@H]2N3C(=O)C5=CC=CC=N5)CO
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing LSM-11632 (CHEBI:100257) is a aromatic carboxylic acid (CHEBI:33859)
LSM-11632 (CHEBI:100257) is a pyridinemonocarboxylic acid (CHEBI:26420)
Manual Xref Database
LSM-11632 LINCS
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