CHEBI:103243 - LSM-14587

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-14587
ChEBI ID CHEBI:103243
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H28F2N4O4
Net Charge 0
Average Mass 486.512
Monoisotopic Mass 486.20786
InChI InChI=1S/C25H28F2N4O4/c1-3-5-14-6-9-19-22-21(23(33)28-10-4-2)16(13-32)20(12-30(19)24(14)34)31(22)25(35)29-18-11-15(26)7-8-17(18)27/h3,5-9,11,16,20-22,32H,4,10,12-13H2,1-2H3,(H,28,33)(H,29,35)/t16-,20-,21+,22+/m1/s1
InChIKey ICXYKFCCQOPFQC-XXMUNEJQSA-N
SMILES CCCNC(=O)[C@H]1[C@@H]([C@H]2CN3C(=CC=C(C3=O)C=CC)[C@@H]1N2C(=O)NC4=C(C=CC(=C4)F)F)CO
ChEBI Ontology
Outgoing LSM-14587 (CHEBI:103243) is a ureas (CHEBI:47857)
Manual Xref Database
LSM-14587 LINCS
View more database links