CHEBI:97116 - LSM-8495

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-8495
ChEBI ID CHEBI:97116
Stars This entity has been manually annotated by a third party.
Supplier Information ChemicalBook:CB3853625, eMolecules:478578, ZINC000001532732
Download Molfile XML SDF
Formula C29H41N3O4
Net Charge 0
Average Mass 495.655
Monoisotopic Mass 495.30971
InChI InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27-/m0/s1
InChIKey RFSXMDVZFWHRJB-FEEANGJJSA-N
SMILES C[C@H]1CN(C(=O)C2=CC=CC=C2C3=CC=CC=C3CO[C@H]1CN(C)C(=O)N[C@H](C)C(C)C)[C@@H](C)CO
ChEBI Ontology
Outgoing LSM-8495 (CHEBI:97116) is a benzenoid aromatic compound (CHEBI:33836)
Manual Xref Database
LSM-8495 LINCS
View more database links