CHEBI:103108 - LSM-14453

ChEBI IDCHEBI:103108
ChEBI NameLSM-14453
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DownloadsMolfile
FormulaC34H38N4O6
Net Charge0
Average Mass598.700
Monoisotopic Mass598.27913
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2c(c3ccccc3n2C)-c2ccccc2CO[C@H]1CN(C)C(=O)Nc1ccc2c(c1)OCO2
InChIInChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30+/m1/s1
InChIKeyKFLLAZWDLYDTFJ-WOGZVKCMSA-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-14453 (CHEBI:103108) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-14453LINCS