Acremonidin d
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Formula: C33H28O14
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Molecular weight: 648.60
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Smiles: CC1=CC(=C(C(=C1CC2=C(C(=C(C=C2C)O)C(=O)C3=C(C=CC(=C3C(=O)OC)O)O)O)O)C(=O)C4=C(C=CC(=C4C(=O)OC)O)O)O
Acremonidin d
Names
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Mycotoxin name: Acremonidin d
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First synonym: Acremonidin d
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Synonyms: Acremonidin D
Identifiers / External links
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CAS: 701914-80-9
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PubChem CID: 10258688
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ChemSpiderID: 8434171
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Chemical Entities of Biological Interest (CHEBI): CHEBI:223300
Structure
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Smiles: CC1=CC(=C(C(=C1CC2=C(C(=C(C=C2C)O)C(=O)C3=C(C=CC(=C3C(=O)OC)O)O)O)O)C(=O)C4=C(C=CC(=C4C(=O)OC)O)O)O
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Isomeric smiles: CC1=CC(=C(C(=C1CC2=C(C(=C(C=C2C)O)C(=O)C3=C(C=CC(=C3C(=O)OC)O)O)O)O)C(=O)C4=C(C=CC(=C4C(=O)OC)O)O)O
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Inchi: InChI=1S/C33H28O14/c1-12-9-20(38)26(30(42)22-16(34)5-7-18(36)24(22)32(44)46-3)28(40)14(12)11-15-13(2)10-21(39)27(29(15)41)31(43)23-17(35)6-8-19(37)25(23)33(45)47-4/h5-10,34-41H,11H2,1-4H3
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Inchikey: PEJXBOKZKHYSKZ-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C33H28O14
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Molecular weight: 648.60
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Monoisotopic mass: 648.14790556
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Fungi
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Fungi id Species 20 Acremonium sp. LL-Cyan 416