Thielavin g
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Formula: C30H32O10
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Molecular weight: 552.60
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Smiles: CC1=CC(=C(C(=C1C(=O)OC2=CC(=C(C(=C2C)C)C(=O)OC3=C(C(=C(C(=C3C)C)C(=O)O)OC)C)OC)O)C)O
Thielavin g
Names
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Mycotoxin name: Thielavin g
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First synonym: Thielavin g
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Synonyms: Thielavin G,CHEMBL3218303
Identifiers / External links
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CAS: 497879-25-1
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PubChem CID: 10370367
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ChEMBL: CHEMBL3218303
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Chemical Entities of Biological Interest (CHEBI): CHEBI:199622
Structure
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Smiles: CC1=CC(=C(C(=C1C(=O)OC2=CC(=C(C(=C2C)C)C(=O)OC3=C(C(=C(C(=C3C)C)C(=O)O)OC)C)OC)O)C)O
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Isomeric smiles: CC1=CC(=C(C(=C1C(=O)OC2=CC(=C(C(=C2C)C)C(=O)OC3=C(C(=C(C(=C3C)C)C(=O)O)OC)C)OC)O)C)O
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Inchi: InChI=1S/C30H32O10/c1-12-10-19(31)17(6)25(32)22(12)29(35)39-20-11-21(37-8)23(14(3)13(20)2)30(36)40-26-16(5)15(4)24(28(33)34)27(38-9)18(26)7/h10-11,31-32H,1-9H3,(H,33,34)
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Inchikey: GMGUUHJTCVMSIG-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C30H32O10
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Molecular weight: 552.60
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Monoisotopic mass: 552.19954721
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Fungi
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Fungi id Species 327 Chaetomium carinthiacum ATCC 46463