CHEBI:125455 - LSM-36947

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-36947
ChEBI ID CHEBI:125455
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C12H8Cl6O
Net Charge 0
Average Mass 380.909
Monoisotopic Mass 377.87063
InChI InChI=1S/C12H8Cl6O/c13-8-9(14)11(16)5-3-1-2(6-7(3)19-6)4(5)10(8,15)12(11,17)18/h2-7H,1H2
InChIKey DFBKLUNHFCTMDC-UHFFFAOYSA-N
SMILES C1C2C3C(C1C4C2O4)C5(C(=C(C3(C5(Cl)Cl)Cl)Cl)Cl)Cl
ChEBI Ontology
Outgoing LSM-36947 (CHEBI:125455) is a monoterpenoid (CHEBI:25409)
Manual Xrefs Databases
HMDB0031211 HMDB
LSM-36947 LINCS
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