Penicolinate A
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Formula: C24H32N2O4
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Molecular weight: 412.50
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Smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCCCC2=CN=C(C=C2)C(=O)OC
Penicolinate A
Names
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Mycotoxin name: Penicolinate A
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First synonym: None
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Synonyms: Penicolinate A,methyl 5-[10-(6-methoxycarbonylpyridin-3-yl)decyl]pyridine-2-carboxylate,methyl 5-(10-(6-methoxycarbonylpyridin-3-yl)decyl)pyridine-2-carboxylate,CHEBI:199899,HY-124301,CS-0086155
Identifiers / External links
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PubChem CID: 71521891
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ChemSpiderID: 68003895
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Chemical Entities of Biological Interest (CHEBI): CHEBI:199899
Structure
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Smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCCCC2=CN=C(C=C2)C(=O)OC
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Isomeric smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCCCC2=CN=C(C=C2)C(=O)OC
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Inchi: InChI=1S/C24H32N2O4/c1-29-23(27)21-15-13-19(17-25-21)11-9-7-5-3-4-6-8-10-12-20-14-16-22(26-18-20)24(28)30-2/h13-18H,3-12H2,1-2H3
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Inchikey: KQNPVQGFUTVYPP-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C24H32N2O4
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Molecular weight: 412.50
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Monoisotopic mass: 412.23620751
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Fungi
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Fungi id Species