Phthioic acid
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Formula: C26H52O2
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Molecular weight: 396.70
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Smiles: CCCCC(C)CCCCCC(C)CCCCCCCCCC(C)CC(=O)O
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Type: Fatty acid
Phthioic acid
Names
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Mycotoxin name: Phthioic acid
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First synonym: None
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Synonyms: Phthioic acid,3,13,19-trimethyltricosanoic acid,3,13,19-trimethyl-tricosanoic acid,LMFA01020022,SCHEMBL5858405,3,13,19-Trimethyltricosansaure,CHEBI:188172
Identifiers / External links
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PubChem CID: 5282606
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ChEMBL: CHEMBL5858405
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Chemical Entities of Biological Interest (CHEBI): CHEBI:188172
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SCHEMBL: SCHEMBL5858405
Structure
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Smiles: CCCCC(C)CCCCCC(C)CCCCCCCCCC(C)CC(=O)O
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Isomeric smiles: CCCCC(C)CCCCCC(C)CCCCCCCCCC(C)CC(=O)O
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Inchi: InChI=1S/C26H52O2/c1-5-6-17-23(2)19-15-12-16-20-24(3)18-13-10-8-7-9-11-14-21-25(4)22-26(27)28/h23-25H,5-22H2,1-4H3,(H,27,28)
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Inchikey: GDZJBTPONREEGO-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C26H52O2
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Molecular weight: 396.70
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Monoisotopic mass: 396.396730897
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Fungi
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Fungi id Species 134 Aspergillus fumigatus