Chokol e
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Formula: C15H28O3
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Molecular weight: 256.38
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Smiles: CC1C(CCC1(C)O)C(=C)CCC(C(C)(C)O)O
Chokol e
Names
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Mycotoxin name: Chokol e
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First synonym: Chokol e
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Synonyms: Chokol E,121979-31-5,(-)-Chokol E,DTXSID40924034,6-(3-hydroxy-2,3-dimethylcyclopentyl)-2-methylhept-6-ene-2,3-diol,6-Heptene-2,3-diol, 6-(3-hydroxy-2,3-dimethylcyclopentyl)-2-methyl-, (1R-(1alpha(R*),2beta,3beta))-
Identifiers / External links
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CAS: 121979-31-5
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PubChem CID: 180085
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CompTox Chemicals Dashboard (DTXSID): DTXSID40924034
Structure
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Smiles: CC1C(CCC1(C)O)C(=C)CCC(C(C)(C)O)O
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Isomeric smiles: C[C@H]1[C@@H](CC[C@@]1(C)O)C(=C)CC[C@H](C(C)(C)O)O
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Inchi: InChI=1S/C15H28O3/c1-10(6-7-13(16)14(3,4)17)12-8-9-15(5,18)11(12)2/h11-13,16-18H,1,6-9H2,2-5H3/t11-,12-,13+,15+/m0/s1
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Inchikey: KSLTUCODDJJNPT-RMRHIDDWSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C15H28O3
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Molecular weight: 256.38
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Monoisotopic mass: 256.20384475
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Fungi
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Fungi id Species 498 Epichloe typhina