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CHEBI:189654 - 4E2RCat

Default Structure
ChEBI IDCHEBI:189654
ChEBI Name4E2RCat
Stars
Submitterjinyangd
DownloadsMolfile
FormulaC22H14ClNO4S2
Net Charge0
Average Mass455.944
Monoisotopic Mass455.00528
SMILES[H]OC(=O)c1c([H])c(-c2oc(/C([H])=C3/SC(=S)N(C([H])([H])c4c([H])c([H])c([H])c([H])c4[H])C3=O)c([H])c2[H])c([H])c([H])c1Cl
InChIInChI=1S/C22H14ClNO4S2/c23-17-8-6-14(10-16(17)21(26)27)18-9-7-15(28-18)11-19-20(25)24(22(29)30-19)12-13-4-2-1-3-5-13/h1-11H,12H2,(H,26,27)/b19-11+
InChIKeyWOBPZFKXPCYOLU-YBFXNURJSA-N
ChEBI Ontology
Outgoing Relation(s)
4E2RCat (CHEBI:189654) is a organic molecular entity (CHEBI:50860)