Terretonin b
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Formula: C26H32O10
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Molecular weight: 504.50
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Smiles: CC1(C(=O)CCC2(C1(C(=O)C(=O)C3(C2(CC(=C)C4(C3C(=O)OC(C4=O)(C)C(=O)OC)C)O)C)O)C)C
Terretonin b
Names
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Mycotoxin name: Terretonin b
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First synonym: Terretonin b
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Synonyms: Terretonin B,865092-87-1
Identifiers / External links
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CAS: 865092-87-1
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PubChem CID: 11641899
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Chemical Entities of Biological Interest (CHEBI): CHEBI:205729
Structure
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Smiles: CC1(C(=O)CCC2(C1(C(=O)C(=O)C3(C2(CC(=C)C4(C3C(=O)OC(C4=O)(C)C(=O)OC)C)O)C)O)C)C
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Isomeric smiles: C[C@]12CCC(=O)C([C@@]1(C(=O)C(=O)[C@@]3([C@@]2(CC(=C)[C@]4([C@H]3C(=O)O[C@@](C4=O)(C)C(=O)OC)C)O)C)O)(C)C
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Inchi: InChI=1S/C26H32O10/c1-12-11-25(33)21(4)10-9-13(27)20(2,3)26(21,34)16(29)15(28)23(25,6)14-17(30)36-24(7,19(32)35-8)18(31)22(12,14)5/h14,33-34H,1,9-11H2,2-8H3/t14-,21-,22+,23-,24-,25+,26-/m1/s1
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Inchikey: UXTSGZSCMMEVEW-RAXSXEJPSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C26H32O10
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Molecular weight: 504.50
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Monoisotopic mass: 504.19954721
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Fungi
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Fungi id Species 263 Aspergillus terreus