Ascherxanthone A
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Formula: C32H34O10
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Molecular weight: 578.60
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Smiles: CC1=CC2=C(C(=C1C3=C(C4=C(C=C3C)OC5(C(C(CC=C5C4=O)OC)O)C)O)O)C(=O)C6=CCC(C(C6(O2)C)O)OC
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Type: Xanthone
Ascherxanthone A
Names
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Mycotoxin name: Ascherxanthone A
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First synonym: None
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Synonyms: Ascherxanthone A,CHEMBL499739,(3S,4R,4aR)-7-[(5R,6S,10aR)-1,5-dihydroxy-6-methoxy-3,10a-dimethyl-9-oxo-6,7-dihydro-5H-xanthen-2-yl]-4,8-dihydroxy-3-methoxy-4a,6-dimethyl-3,4-dihydro-2H-xanthen-9-one
Identifiers / External links
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PubChem CID: 11478721
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ChemSpiderID: 9653546
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ChEMBL: CHEMBL499739
Structure
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Smiles: CC1=CC2=C(C(=C1C3=C(C4=C(C=C3C)OC5(C(C(CC=C5C4=O)OC)O)C)O)O)C(=O)C6=CCC(C(C6(O2)C)O)OC
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Isomeric smiles: CC1=CC2=C(C(=C1C3=C(C4=C(C=C3C)O[C@]5([C@@H]([C@H](CC=C5C4=O)OC)O)C)O)O)C(=O)C6=CC[C@@H]([C@H]([C@@]6(O2)C)O)OC
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Inchi: InChI=1S/C32H34O10/c1-13-11-19-23(25(33)15-7-9-17(39-5)29(37)31(15,3)41-19)27(35)21(13)22-14(2)12-20-24(28(22)36)26(34)16-8-10-18(40-6)30(38)32(16,4)42-20/h7-8,11-12,17-18,29-30,35-38H,9-10H2,1-6H3/t17-,18-,29+,30+,31+,32+/m0/s1
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Inchikey: RLBXNYCARFXYIU-RIJKSYFQSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C32H34O10
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Molecular weight: 578.60
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Monoisotopic mass: 578.21519728
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Fungi
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Fungi id Species