Myrothenone a
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Formula: C8H9NO3
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Molecular weight: 167.16
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Smiles: C=CC1(CC(=CC1=O)NC=O)O
Myrothenone a
Names
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Mycotoxin name: Myrothenone a
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First synonym: Myrothenone a
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Synonyms: Myrothenone A,(5R)-5-ethenyl-3-formamido-5-hydroxy-2-cyclopenten-1-one,N-[(4R)-4-ethenyl-4-hydroxy-3-oxocyclopent-1-en-1-yl]formamide,N-[(4R)-4-hydroxy-3-oxo-4-vinylcyclopent-1-en-1-yl]formamide,CHEBI:66424,Q27134983
Identifiers / External links
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CAS: 858126-03-1
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PubChem CID: 11355692
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ChemSpiderID: 9530619
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Wikidata (wiki): Q27134983
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Chemical Entities of Biological Interest (CHEBI): CHEBI:66424
Structure
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Smiles: C=CC1(CC(=CC1=O)NC=O)O
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Isomeric smiles: C=C[C@@]1(CC(=CC1=O)NC=O)O
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Inchi: InChI=1S/C8H9NO3/c1-2-8(12)4-6(9-5-10)3-7(8)11/h2-3,5,12H,1,4H2,(H,9,10)/t8-/m0/s1
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Inchikey: PGQRZOUYTNKEBE-QMMMGPOBSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C8H9NO3
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Molecular weight: 167.16
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Monoisotopic mass: 167.058243149
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Fungi
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Fungi id Species 656 Myrothecium sp.