terrecyclic acid a
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Formula: C15H20O3
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Molecular weight: 248.32
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Smiles: CC1(CC23C(CCC1C2CC(=O)C3=C)C(=O)O)C
terrecyclic acid a
Names
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Mycotoxin name: terrecyclic acid a
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First synonym: (-)-terrecyclic acid a
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Synonyms: (-)-Terrecyclic acid A,UNII-OW4R74E2RX,OW4R74E2RX,(+)-terrecyclic acid A,Terrecyclic acid A, (-)-,NSC366225,Terrecyclic acid (-)-form [MI],CHEMBL469079,3a,7-Ethano-3ah-indene-4-carboxylic acid, octahydro-8,8-dimethyl-3-methylene-2-oxo-, (3aR,4S,7S,7aS)-,93219-11-5,Q27285878
Identifiers / External links
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CAS: 83058-94-0,93219-11-5
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PubChem CID: 339487
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ChemSpiderID: 300938
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ChEMBL: CHEMBL469079,CHEMBL847006
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US FDA (UNII): UNII-N3373G7D58,UNII-OW4R74E2RX
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Wikidata (wiki): Q27285878,Q27284458
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SCHEMBL: SCHEMBL847006
Structure
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Smiles: CC1(CC23C(CCC1C2CC(=O)C3=C)C(=O)O)C
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Isomeric smiles: CC1(C[C@@]23[C@@H](CC[C@@H]1[C@H]2CC(=O)C3=C)C(=O)O)C
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Inchi: InChI=1S/C15H20O3/c1-8-12(16)6-11-9-4-5-10(13(17)18)15(8,11)7-14(9,2)3/h9-11H,1,4-7H2,2-3H3,(H,17,18)/t9-,10+,11-,15-/m1/s1
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Inchikey: SMAWCSOVJJHIOI-JNIYBQFBSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C15H20O3
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Molecular weight: 248.32
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Monoisotopic mass: 248.1412445
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Fungi
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Fungi id Species 272 Aspergillus terreus No. 14