CHEBI:100841 - LSM-12215

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ChEBI Name LSM-12215
ChEBI ID CHEBI:100841
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C31H36N2O6
Net Charge 0
Average Mass 532.629
Monoisotopic Mass 532.25734
InChI InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29-/m0/s1
InChIKey FTPUTVYFFNSJIR-SYZUXVNWSA-N
SMILES C[C@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@H]1CN(C)C(=O)OC4=CC=C(C=C4)OC)[C@@H](C)CO
ChEBI Ontology
Outgoing LSM-12215 (CHEBI:100841) is a methoxybenzenes (CHEBI:51683)
Manual Xref Database
LSM-12215 LINCS
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