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CHEBI:80008 - BILA 2185BS

ChEBI IDCHEBI:80008
ChEBI NameBILA 2185BS
Stars
DownloadsMolfile
FormulaC35H46N4O4S
Net Charge0
Average Mass618.844
Monoisotopic Mass618.32398
SMILESCc1cccc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN1CC[C@@H](Sc2ccncc2)C[C@H]1C(=O)NC(C)(C)C
InChIInChI=1S/C35H46N4O4S/c1-24-10-9-11-25(2)33(24)43-23-32(41)37-29(20-26-12-7-6-8-13-26)31(40)22-39-19-16-28(44-27-14-17-36-18-15-27)21-30(39)34(42)38-35(3,4)5/h6-15,17-18,28-31,40H,16,19-23H2,1-5H3,(H,37,41)(H,38,42)/t28-,29+,30+,31-/m1/s1
InChIKeyWVPSCZBMYQIZMS-QNRWOPMTSA-N
ChEBI Ontology
Outgoing Relation(s)
BILA 2185BS (CHEBI:80008) is a amino acid amide (CHEBI:22475)
Manual XrefsDatabases
C15657KEGG COMPOUND
Registry NumbersSources
CAS:154612-58-5KEGG COMPOUND