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CHEBI:119245 - LSM-30694

ChEBI IDCHEBI:119245
ChEBI NameLSM-30694
Stars
DownloadsMolfile
FormulaC34H39N3O5
Net Charge0
Average Mass569.702
Monoisotopic Mass569.28897
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@@H]1CN(C)Cc1ccc(C(=O)O)cc1
InChIInChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m1/s1
InChIKeyYIOWAERVOJZIKA-DUELTEGESA-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-30694 (CHEBI:119245) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-30694LINCS