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CHEBI:100968 - LSM-12341

ChEBI IDCHEBI:100968
ChEBI NameLSM-12341
Stars
DownloadsMolfile
FormulaC30H37N3O4
Net Charge0
Average Mass503.643
Monoisotopic Mass503.27841
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@H]1CN(C)C(=O)C1CC1
InChIInChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26+/m1/s1
InChIKeyYAQCSVWFCUIVLJ-KYTVRQNUSA-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-12341 (CHEBI:100968) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-12341LINCS