CHEBI:98603 - LSM-9982

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-9982
ChEBI ID CHEBI:98603
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H33FN2O4
Net Charge 0
Average Mass 504.594
Monoisotopic Mass 504.24244
InChI InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m0/s1
InChIKey HTGRXZBGTMWDTQ-CZBREUMFSA-N
SMILES C[C@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@H]1CN(C)C(=O)C4=CC=C(C=C4)F)[C@@H](C)CO
ChEBI Ontology
Outgoing LSM-9982 (CHEBI:98603) is a carbonyl compound (CHEBI:36586)
LSM-9982 (CHEBI:98603) is a organohalogen compound (CHEBI:17792)
Manual Xref Database
LSM-9982 LINCS
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