CHEBI:102458 - LSM-13809

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ChEBI Name LSM-13809
ChEBI ID CHEBI:102458
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H35N3O6S
Net Charge 0
Average Mass 541.661
Monoisotopic Mass 541.22466
InChI InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19+,26-/m1/s1
InChIKey UYIXVJNNAXNMSD-UYXZNNOOSA-N
SMILES C[C@@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@@H]1CN(C)S(=O)(=O)C4=C(ON=C4C)C)[C@@H](C)CO
ChEBI Ontology
Outgoing LSM-13809 (CHEBI:102458) is a benzenoid aromatic compound (CHEBI:33836)
Manual Xref Database
LSM-13809 LINCS
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