CHEBI:95091 - LSM-6343

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-6343
ChEBI ID CHEBI:95091
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C33H39N7O4
Net Charge 0
Average Mass 597.709
Monoisotopic Mass 597.30635
InChI InChI=1S/C33H39N7O4/c1-22-8-7-9-23(2)32(22)37-33(41)40(27-13-11-25(42-4)19-29(27)44-6)31-20-30(34-21-35-31)36-26-12-10-24(18-28(26)43-5)39-16-14-38(3)15-17-39/h7-13,18-21H,14-17H2,1-6H3,(H,37,41)(H,34,35,36)
InChIKey YVHQGJBMHCXEPW-UHFFFAOYSA-N
SMILES CC1=C(C(=CC=C1)C)NC(=O)N(C2=C(C=C(C=C2)OC)OC)C3=NC=NC(=C3)NC4=C(C=C(C=C4)N5CCN(CC5)C)OC
ChEBI Ontology
Outgoing LSM-6343 (CHEBI:95091) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-6343 LINCS
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