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CHEBI:119384 - LSM-30833

Default Structure
ChEBI IDCHEBI:119384
ChEBI NameLSM-30833
Stars
DownloadsMolfile
FormulaC33H37N3O4
Net Charge0
Average Mass539.676
Monoisotopic Mass539.27841
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@@H]1CN(C)C(=O)c1ccccc1
InChIInChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29-/m1/s1
InChIKeyULIRFODWPVJJJM-VDWGHMIBSA-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-30833 (CHEBI:119384) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-30833LINCS