saperconazole
chemical compound
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saperconazole
Summary
saperconazole is a group of stereoisomers[1].
Key Facts
- saperconazole's instance of is recorded as group of stereoisomers[2].
- saperconazole's chemical structure is recorded as Saperconazole.svg[3].
- saperconazole's CAS Registry Number is recorded as 110588-57-3[4].
- saperconazole's canonical SMILES is recorded as CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5COC(O5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F[5].
- saperconazole's InChI is recorded as InChI=1S/C35H38F2N8O4/c1-3-25(2)45-34(46)44(24-40-45)29-7-5-27(6-8-29)41-14-16-42(17-15-41)28-9-11-30(12-10-28)47-19-31-20-48-35(49-31,21-43-23-38-22-39-43)32-13-4-26(36)18-33(32)37/h4-13,18,22-25,31H,3,14-17,19-21H2,1-2H3/t25?,31-,35-/m1/s1[6].
- saperconazole's InChIKey is recorded as HUADITLKOCMHSB-AVQIMAJZSA-N[7].
- saperconazole's chemical formula is recorded as C₃₅H₃₈F₂N₈O₄[8].
- saperconazole's subclass of is recorded as chemical compound[9].
- saperconazole's MeSH descriptor ID is recorded as C060571[10].
- saperconazole's UNII is recorded as R2I5PI29CA[11].
- saperconazole's ChemSpider ID is recorded as 54510[12].
- saperconazole's PubChem CID is recorded as 60456[13].
- saperconazole's isomeric SMILES is recorded as CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC[C@@H]5COC@@(CN6C=NC=N6)C7=C(C=C(C=C7)F)FC@@(CN6C=NC=N6)C7=C(C=C(C=C7)F)F">[14].
- saperconazole's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+672.298'}[15].
- saperconazole's subject has role is recorded as antifungal[16].
- saperconazole's SureChEMBL ID is recorded as 1650334[17].
- saperconazole's UMLS CUI is recorded as C0074037[18].
- saperconazole's DSSTox substance ID is recorded as DTXSID10891401[19].
- saperconazole's CAB ID is recorded as 33444[20].
- saperconazole's DSSTOX compound identifier is recorded as DTXCID701030520[21].
- saperconazole's UniChem compound ID is recorded as 199989[22].