Talaromycin e
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Formula: C12H22O4
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Molecular weight: 230.30
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Smiles: CCC1CCC2(CC(C(CO2)CO)O)OC1
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Type: Talaromycins
Talaromycin e
Names
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Mycotoxin name: Talaromycin e
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First synonym: Talaromycin e
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Synonyms: Talaromycin E,111465-42-0,DTXSID50912169,1,7-Dioxaspiro(5.5)undecane-3-methanol, 9-ethyl-4-hydroxy-, (3S-(3alpha,4alpha,6alpha(S*)))-
Identifiers / External links
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CAS: 111465-42-0
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PubChem CID: 183311
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CompTox Chemicals Dashboard (DTXSID): DTXSID50912169
Structure
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Smiles: CCC1CCC2(CC(C(CO2)CO)O)OC1
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Isomeric smiles: CC[C@@H]1CCC2(C[C@H]([C@H](CO2)CO)O)OC1
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Inchi: InChI=1S/C12H22O4/c1-2-9-3-4-12(15-7-9)5-11(14)10(6-13)8-16-12/h9-11,13-14H,2-8H2,1H3/t9-,10+,11-,12?/m1/s1
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Inchikey: VDWRKBZMQNPUOB-FBTJUVTCSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H22O4
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Molecular weight: 230.30
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Monoisotopic mass: 230.15180918
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Fungi
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Fungi id Species 1129 Talaromyces stipitatus