Massarinolin B
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Formula: C15H22O4
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Molecular weight: 266.33
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Smiles: CC(=CC(CC12COC3(C1CC2CC3)C)O)C(=O)O
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Type: Oxatricyclononene
Massarinolin B
Names
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Mycotoxin name: Massarinolin B
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First synonym: None
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Synonyms: Massarinolin B,Mabetaarinolin B,CHEBI:209846,(E,4S)-4-hydroxy-2-methyl-5-[(1R,3S,6R,9S)-6-methyl-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]pent-2-enoic acid
Identifiers / External links
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PubChem CID: 10539696
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ChemSpiderID: 8715087
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Chemical Entities of Biological Interest (CHEBI): CHEBI:209846
Structure
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Smiles: CC(=CC(CC12COC3(C1CC2CC3)C)O)C(=O)O
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Isomeric smiles: C/C(=C\[C@H](C[C@@]12CO[C@]3([C@@H]1C[C@@H]2CC3)C)O)/C(=O)O
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Inchi: InChI=1S/C15H22O4/c1-9(13(17)18)5-11(16)7-15-8-19-14(2)4-3-10(15)6-12(14)15/h5,10-12,16H,3-4,6-8H2,1-2H3,(H,17,18)/b9-5+/t10-,11+,12-,14+,15-/m0/s1
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Inchikey: GWNSZLIEAQMRLS-SUAOZZTGSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C15H22O4
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Molecular weight: 266.33
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Monoisotopic mass: 266.15180918
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Fungi
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Fungi id Species