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CHEBI:101616 - LSM-12979

ChEBI IDCHEBI:101616
ChEBI NameLSM-12979
Stars
DownloadsMolfile
FormulaC32H39N5O5
Net Charge0
Average Mass573.694
Monoisotopic Mass573.29512
SMILESCc1noc(C)c1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(n(C)c3ccccc23)C(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m1/s1
InChIKeyWBCPGODJHKXDGU-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-12979 (CHEBI:101616) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-12979LINCS