CHEBI:101481 - LSM-12844

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ChEBI Name LSM-12844
ChEBI ID CHEBI:101481
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H29F2N5O4
Net Charge 0
Average Mass 489.516
Monoisotopic Mass 489.21876
InChI InChI=1S/C24H29F2N5O4/c1-29(2)10-4-9-27-23(34)21-15(13-32)19-12-30-18(5-3-6-20(30)33)22(21)31(19)24(35)28-17-11-14(25)7-8-16(17)26/h3,5-8,11,15,19,21-22,32H,4,9-10,12-13H2,1-2H3,(H,27,34)(H,28,35)/t15-,19-,21+,22+/m1/s1
InChIKey CIBCEUNPWMQAQP-VVBCARDSSA-N
SMILES CN(C)CCCNC(=O)[C@H]1[C@@H]([C@H]2CN3C(=O)C=CC=C3[C@@H]1N2C(=O)NC4=C(C=CC(=C4)F)F)CO
ChEBI Ontology
Outgoing LSM-12844 (CHEBI:101481) is a ureas (CHEBI:47857)
Manual Xref Database
LSM-12844 LINCS
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