Epi-chaetoviridin a
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Formula: C23H25ClO6
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Molecular weight: 432.90
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Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C(=C(C(=O)O3)C(=O)C(C)C(C)O)C2=CO1)C)Cl
Epi-chaetoviridin a
Names
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Mycotoxin name: Epi-chaetoviridin a
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First synonym: 5'-epichaetoviridin a
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Synonyms: 5'-Epichaetoviridin A,5'-epi-Chaetoviridin A,CHEBI:67615,epi-Chaetoviridin A,CHEMBL1802155,Q27136082,(6aS)-5-chloro-9-[(2S,3S)-3-hydroxy-2-methylbutanoyl]-6a-methyl-3-[(1E,3S)-3-methylpent-1-en-1-yl]-6H-furo[2,3-h]isochromene-6,8(6aH)-dione
Identifiers / External links
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PubChem CID: 53262700
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ChEMBL: CHEMBL1802155
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Wikidata (wiki): Q27136082
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Chemical Entities of Biological Interest (CHEBI): CHEBI:67615
Structure
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Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C(=C(C(=O)O3)C(=O)C(C)C(C)O)C2=CO1)C)Cl
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Isomeric smiles: CC[C@H](C)/C=C/C1=CC2=C(C(=O)[C@@]3(C(=C(C(=O)O3)C(=O)[C@@H](C)[C@H](C)O)C2=CO1)C)Cl
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Inchi: InChI=1S/C23H25ClO6/c1-6-11(2)7-8-14-9-15-16(10-29-14)18-17(20(26)12(3)13(4)25)22(28)30-23(18,5)21(27)19(15)24/h7-13,25H,6H2,1-5H3/b8-7+/t11-,12-,13-,23-/m0/s1
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Inchikey: HWSQVPGTQUYLEQ-XURDPWNDSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C23H25ClO6
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Molecular weight: 432.90
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Monoisotopic mass: 432.1339662
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Fungi
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Fungi id Species 334 Chaetomium globosum