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CHEBI:101645 - LSM-13008

ChEBI IDCHEBI:101645
ChEBI NameLSM-13008
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DownloadsMolfile
FormulaC27H35N3O3
Net Charge0
Average Mass449.595
Monoisotopic Mass449.26784
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@@H]1CN(C)C
InChIInChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m0/s1
InChIKeyWKBGSUAXJVLQSN-AXHZCLLHSA-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-13008 (CHEBI:101645) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-13008LINCS