CHEBI:101967 - LSM-13328

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ChEBI Name LSM-13328
ChEBI ID CHEBI:101967
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C32H38N4O3
Net Charge 0
Average Mass 526.670
Monoisotopic Mass 526.29439
InChI InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m0/s1
InChIKey RPGWXCDGQSLPTH-BOSRLCDASA-N
SMILES C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@H]1CN(C)CC4=CN=CC=C4)C5=CC=CC=C5N2C)[C@@H](C)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-13328 (CHEBI:101967) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-13328 LINCS
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