PM-toxin B
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Formula: C33H62O8
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Molecular weight: 586.80
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Smiles: CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(C)O)O)O)O)O
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Type: Polyketide
PM-toxin B
Names
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Mycotoxin name: PM-toxin B
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First synonym: None
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Synonyms: PM-toxin B,87879-56-9,(6R,14R,22R,30R,32S)-6,14,22,30,32-pentahydroxytritriacontane-8,16,24-trione,8,16,24-Tritriacontanetrione, 6,14,22,30,32-pentahydroxy-, (6R,14R,22R,30R,32S)-,CHEBI:80725,DTXSID90236679,Q27149773
Identifiers / External links
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CAS: 87879-56-9
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PubChem CID: 159171
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Wikidata (wiki): Q27149773
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Chemical Entities of Biological Interest (CHEBI): CHEBI:80725
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CompTox Chemicals Dashboard (DTXSID): DTXSID90236679
Structure
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Smiles: CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(=O)CCCCCC(CC(C)O)O)O)O)O
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Isomeric smiles: CCCCC[C@H](CC(=O)CCCCC[C@H](CC(=O)CCCCC[C@H](CC(=O)CCCCC[C@H](C[C@H](C)O)O)O)O)O
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Inchi: InChI=1S/C33H62O8/c1-3-4-8-15-28(36)23-29(37)18-11-6-12-19-32(40)25-33(41)21-14-7-13-20-31(39)24-30(38)17-10-5-9-16-27(35)22-26(2)34/h26-28,31-32,34-36,39-40H,3-25H2,1-2H3/t26-,27+,28+,31+,32+/m0/s1
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Inchikey: ISDLLJGHFWSQQK-ZHTCHCOESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C33H62O8
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Molecular weight: 586.80
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Monoisotopic mass: 586.44446893
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Fungi
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Fungi id Species