Cycloclavine
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Formula: C16H18N2
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Molecular weight: 238.33
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Smiles: CC12CC13C(CC4=CNC5=CC=CC3=C45)N(C2)C
Cycloclavine
Names
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Mycotoxin name: Cycloclavine
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First synonym: Cycloclavine
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Synonyms: Cycloclavine,SCHEMBL15828351,Q15633927,(9bS)-1abeta,3-Dimethyl-1a,2,3,3abeta,4,6-hexahydro-1H-cyclopropa[c]indolo[4,3-ef]indole
Identifiers / External links
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PubChem CID: 24823847
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ChemSpiderID: 25991549
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ChEMBL: CHEMBL15828351
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Wikidata (wiki): Q15633927,Q6
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Chemical Entities of Biological Interest (CHEBI): CHEBI:204810
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CompTox Chemicals Dashboard (DTXSID): DTXSID701045769
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SCHEMBL: SCHEMBL15828351
Structure
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Smiles: CC12CC13C(CC4=CNC5=CC=CC3=C45)N(C2)C
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Isomeric smiles: C[C@]12C[C@@]13[C@@H](CC4=CNC5=CC=CC3=C45)N(C2)C
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Inchi: InChI=1S/C16H18N2/c1-15-8-16(15)11-4-3-5-12-14(11)10(7-17-12)6-13(16)18(2)9-15/h3-5,7,13,17H,6,8-9H2,1-2H3/t13-,15-,16-/m1/s1
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Inchikey: ZWJHDICNUKHUGE-FVQBIDKESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C16H18N2
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Molecular weight: 238.33
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Monoisotopic mass: 238.146998583
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Fungi
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Fungi id Species 163 Aspergillus japonicus