Chokol a
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Formula: C12H22O2
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Molecular weight: 198.30
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Smiles: CC1C(CCC1(C)O)C(=C)CCCO
Chokol a
Names
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Mycotoxin name: Chokol a
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First synonym: 99877-51-7
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Synonyms: 99877-51-7,(-)-Chokol A,NSC630450,Chokol A,CHEMBL1986419,DTXSID70912429,NSC-630450,NCI60_009909,3-(5-hydroxypent-1-en-2-yl)-1,2-dimethylcyclopentan-1-ol
Identifiers / External links
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CAS: 99877-51-7
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PubChem CID: 181328
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ChemSpiderID: 157753
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ChEMBL: CHEMBL1986419
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CompTox Chemicals Dashboard (DTXSID): DTXSID70912429
Structure
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Smiles: CC1C(CCC1(C)O)C(=C)CCCO
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Isomeric smiles: C[C@H]1[C@@H](CC[C@@]1(C)O)C(=C)CCCO
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Inchi: InChI=1S/C12H22O2/c1-9(5-4-8-13)11-6-7-12(3,14)10(11)2/h10-11,13-14H,1,4-8H2,2-3H3/t10-,11-,12+/m0/s1
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Inchikey: MLBPPDRXJFCPML-SDDRHHMPSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H22O2
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Molecular weight: 198.30
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Monoisotopic mass: 198.16197994
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Fungi
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Fungi id Species 498 Epichloe typhina