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CHEBI:98327 - LSM-9706

ChEBI IDCHEBI:98327
ChEBI NameLSM-9706
Stars
DownloadsMolfile
FormulaC32H38N4O5
Net Charge0
Average Mass558.679
Monoisotopic Mass558.28422
SMILESCc1noc(C)c1C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27+/m1/s1
InChIKeyLBGXIXNVJUEMSO-JVAFGIKQSA-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-9706 (CHEBI:98327) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-9706LINCS