Arisugacin g
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Formula: C27H32O5
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Molecular weight: 436.50
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Smiles: CC1(C2CCC3(C(C2(CCC1=O)C)CC4=C(O3)C=C(OC4=O)C5=CC=C(C=C5)OC)C)C
Arisugacin g
Names
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Mycotoxin name: Arisugacin g
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First synonym: Chembl3632856
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Synonyms: CHEMBL3632856,Arisugacin G,BDBM50130206
Identifiers / External links
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CAS: 261951-57-9
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PubChem CID: 10646592
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ChemSpiderID: 8821951
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ChEMBL: CHEMBL3632856
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Chemical Entities of Biological Interest (CHEBI): CHEBI:206612
Structure
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Smiles: CC1(C2CCC3(C(C2(CCC1=O)C)CC4=C(O3)C=C(OC4=O)C5=CC=C(C=C5)OC)C)C
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Isomeric smiles: C[C@]12CCC(=O)C([C@@H]1CC[C@@]3([C@@H]2CC4=C(O3)C=C(OC4=O)C5=CC=C(C=C5)OC)C)(C)C
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Inchi: InChI=1S/C27H32O5/c1-25(2)21-10-13-27(4)22(26(21,3)12-11-23(25)28)14-18-20(32-27)15-19(31-24(18)29)16-6-8-17(30-5)9-7-16/h6-9,15,21-22H,10-14H2,1-5H3/t21-,22+,26-,27+/m0/s1
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Inchikey: YKIBSZXLXSOWFC-HXABMTEBSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C27H32O5
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Molecular weight: 436.50
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Monoisotopic mass: 436.22497412
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Fungi
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Fungi id Species 950 Penicillium sp. FO-4259-11