CHEBI:79997 - GW 4064

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ChEBI Name GW 4064
ChEBI ID CHEBI:79997
Stars This entity has been manually annotated by a third party.
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Formula C28H22Cl3NO4
Net Charge 0
Average Mass 542.83800
Monoisotopic Mass 541.06144
InChI InChI=1S/C28H22Cl3NO4/c1-16(2)27-21(26(32-36-27)25-22(29)7-4-8-23(25)30)15-35-20-12-11-18(24(31)14-20)10-9-17-5-3-6-19(13-17)28(33)34/h3-14,16H,15H2,1-2H3,(H,33,34)/b10-9+
InChIKey BYTNEISLBIENSA-MDZDMXLPSA-N
SMILES CC(C)c1onc(c1COc1ccc(\C=C\c2cccc(c2)C(O)=O)c(Cl)c1)-c1c(Cl)cccc1Cl
ChEBI Ontology
Outgoing GW 4064 (CHEBI:79997) is a stilbenoid (CHEBI:26776)
Manual Xrefs Databases
064 PDBeChem
C15635 KEGG COMPOUND
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Registry Number Type Source
278779-30-9 CAS Registry Number KEGG COMPOUND