6-methoxy-3-(2-thiazolyl)-1h-indole
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Formula: C12H10N2OS
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Molecular weight: 230.29
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Smiles: COC1=CC2=C(C=C1)C(=CN2)C3=NC=CS3
6-methoxy-3-(2-thiazolyl)-1h-indole
Names
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Mycotoxin name: 6-methoxy-3-(2-thiazolyl)-1h-indole
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First synonym: 6-methoxycamalexin
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Synonyms: 6-METHOXYCAMALEXIN,6-methoxy-3-(1,3-thiazol-2-yl)-1H-indole,135531-87-2,6-Methoxy-3-(2-thiazolyl)-1H-indole,1H-Indole, 6-methoxy-3-(2-thiazolyl)-,Methoxycamalexin,ACMC-20mvsq,CHEMBL2251538,SCHEMBL12993653,DTXSID70457289,CHEBI:136941,6-methoxy-3-(thiazol-2-yl)indole,6-methoxy-3-thiazol-2-yl-1H-indole,2-(6-methoxy-1H-indol-3-yl)thiazole
Identifiers / External links
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CAS: 135531-87-2
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PubChem CID: 11160579
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ChemSpiderID: 9335679
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ChEMBL: CHEMBL12993653,CHEMBL2251538
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Chemical Entities of Biological Interest (CHEBI): CHEBI:136941
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CompTox Chemicals Dashboard (DTXSID): DTXSID70457289
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SCHEMBL: SCHEMBL12993653
Structure
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Smiles: COC1=CC2=C(C=C1)C(=CN2)C3=NC=CS3
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Isomeric smiles: COC1=CC2=C(C=C1)C(=CN2)C3=NC=CS3
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Inchi: InChI=1S/C12H10N2OS/c1-15-8-2-3-9-10(7-14-11(9)6-8)12-13-4-5-16-12/h2-7,14H,1H3
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Inchikey: FGXYYCWDPYDAOS-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H10N2OS
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Molecular weight: 230.29
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Monoisotopic mass: 230.05138412
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Fungi
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Fungi id Species 32 Alternaria brassicae