CHEBI:103321 - LSM-14665

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-14665
ChEBI ID CHEBI:103321
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H25F2N3O5S
Net Charge 0
Average Mass 493.525
Monoisotopic Mass 493.14830
InChI InChI=1S/C23H25F2N3O5S/c1-3-4-14-5-6-18-21-20(22(30)26-10-13-7-15(24)9-16(25)8-13)17(12-29)19(11-27(18)23(14)31)28(21)34(2,32)33/h3-9,17,19-21,29H,10-12H2,1-2H3,(H,26,30)/t17-,19-,20+,21+/m1/s1
InChIKey GJMSSMVDMJSJLU-PBASOCQRSA-N
SMILES CC=CC1=CC=C2[C@H]3[C@H]([C@@H]([C@H](N3S(=O)(=O)C)CN2C1=O)CO)C(=O)NCC4=CC(=CC(=C4)F)F
ChEBI Ontology
Outgoing LSM-14665 (CHEBI:103321) is a pyrrolidinecarboxamide (CHEBI:46770)
Manual Xref Database
LSM-14665 LINCS
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