EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:99244 - LSM-10623

ChEBI IDCHEBI:99244
ChEBI NameLSM-10623
Stars
DownloadsMolfile
FormulaC34H40N4O5
Net Charge0
Average Mass584.717
Monoisotopic Mass584.29987
SMILESCOc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(n(C)c4ccccc34)C(=O)N([C@@H](C)CO)C[C@@H]2C)c1
InChIInChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1
InChIKeyFNKQMQRSMOAQIH-ZRLASMASSA-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-10623 (CHEBI:99244) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-10623LINCS