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CHEBI:100753 - LSM-12127

ChEBI IDCHEBI:100753
ChEBI NameLSM-12127
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DownloadsMolfile
FormulaC26H33N3O3
Net Charge0
Average Mass435.568
Monoisotopic Mass435.25219
SMILESCNC[C@H]1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C26H33N3O3/c1-17-14-29(18(2)15-30)26(31)25-24(21-11-7-8-12-22(21)28(25)4)20-10-6-5-9-19(20)16-32-23(17)13-27-3/h5-12,17-18,23,27,30H,13-16H2,1-4H3/t17-,18-,23-/m1/s1
InChIKeyNEAMIVWIATVNNI-PMAPCBKXSA-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-12127 (CHEBI:100753) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-12127LINCS