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CHEBI:97305 - LSM-8684

ChEBI IDCHEBI:97305
ChEBI NameLSM-8684
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DownloadsMolfile
FormulaC31H41N3O5
Net Charge0
Average Mass535.685
Monoisotopic Mass535.30462
SMILESCC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N([C@H](C)CO)C[C@@H]1C
InChIInChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27-/m0/s1
InChIKeyQLIZXZIZGKFZES-XXAUWVGASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
LSM-8684 (CHEBI:97305) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-8684LINCS