CHEBI:100944 - LSM-12317

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ChEBI Name LSM-12317
ChEBI ID CHEBI:100944
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C31H37N3O5
Net Charge 0
Average Mass 531.644
Monoisotopic Mass 531.27332
InChI InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1
InChIKey WYYHNXRAZIWUBG-IEOSBIPESA-N
SMILES C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NC4=CC(=CC=C4)OC)[C@H](C)CO
ChEBI Ontology
Outgoing LSM-12317 (CHEBI:100944) is a ureas (CHEBI:47857)
Manual Xref Database
LSM-12317 LINCS
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