CHEBI:101985 - LSM-13346

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ChEBI Name LSM-13346
ChEBI ID CHEBI:101985
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C29H33FN2O5S
Net Charge 0
Average Mass 540.648
Monoisotopic Mass 540.20942
InChI InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1
InChIKey QWRJLEHIBFFHOL-LGVUCKNBSA-N
SMILES C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CN(C)S(=O)(=O)C4=CC=CC=C4F)[C@H](C)CO
ChEBI Ontology
Outgoing LSM-13346 (CHEBI:101985) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-13346 LINCS
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