12-oxocurvularin
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Formula: C16H18O6
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Molecular weight: 306.31
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Smiles: CC1CCC(=O)CCC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O
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Type: Resorcyl lactone
12-oxocurvularin
Names
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Mycotoxin name: 12-oxocurvularin
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First synonym: Q63409644
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Synonyms: Q63409644,7-Oxocurvularin,12-oxocurvularin,MEGxm0_000245,(4S)-4,5,6,9-Tetrahydro-11,13-dihydroxy-4-methyl-2H-3-benzoxacyclododecin-2,7,10(1H,8H)-trione
Identifiers / External links
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PubChem CID: 14314901
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ChemSpiderID: 24608524
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Wikidata (wiki): Q63409644
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Chemical Entities of Biological Interest (CHEBI): CHEBI:209857
Structure
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Smiles: CC1CCC(=O)CCC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O
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Isomeric smiles: C[C@H]1CCC(=O)CCC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O
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Inchi: InChI=1S/C16H18O6/c1-9-2-3-11(17)4-5-13(19)16-10(7-15(21)22-9)6-12(18)8-14(16)20/h6,8-9,18,20H,2-5,7H2,1H3/t9-/m0/s1
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Inchikey: MFGVWPFVDDUSLL-VIFPVBQESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C16H18O6
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Molecular weight: 306.31
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Monoisotopic mass: 306.11033829
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Fungi
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Fungi id Species