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CHEBI:119404 - LSM-30853

ChEBI IDCHEBI:119404
ChEBI NameLSM-30853
Stars
DownloadsMolfile
FormulaC33H39N3O6S
Net Charge0
Average Mass605.757
Monoisotopic Mass605.25596
SMILESCOc1ccc(S(=O)(=O)N(C)C[C@H]2OCc3ccccc3-c3c(n(C)c4ccccc34)C(=O)N([C@H](C)CO)C[C@@H]2C)cc1
InChIInChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m0/s1
InChIKeyGGYLTZASASDOIP-DDFCPOBKSA-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-30853 (CHEBI:119404) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-30853LINCS