Isotrichodermol
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Formula: C15H22O3
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Molecular weight: 250.33
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Smiles: CC1=CC2C(CC1)(C3(CC(C(C34CO4)O2)O)C)C
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Type: Trichothecene
Isotrichodermol
Names
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Mycotoxin name: Isotrichodermol
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First synonym: Isotrichodermol
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Synonyms: Isotrichodermol,UNII-46VQD5MCP0,46VQD5MCP0,104155-10-4,3-hydroxytrichothecene,CHEBI:157603,12,13-epoxytrichothec-9-en-3alpha-ol,Trichothec-9-en-3alpha-ol, 12,13-epoxy-,(3alpha)-12,13-epoxytrichothec-9-en-3-ol,Trichothec-9-en-3-ol, 12,13-epoxy-, (3alpha)-,Q27258962
Identifiers / External links
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CAS: 104155-10-4
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PubChem CID: 21125670
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ChemSpiderID: 165671
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US FDA (UNII): UNII-46VQD5MCP0
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Wikidata (wiki): Q27258962
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Chemical Entities of Biological Interest (CHEBI): CHEBI:157603
Structure
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Smiles: CC1=CC2C(CC1)(C3(CC(C(C34CO4)O2)O)C)C
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Isomeric smiles: CC1=C[C@@H]2[C@](CC1)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)O)C)C
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Inchi: InChI=1S/C15H22O3/c1-9-4-5-13(2)11(6-9)18-12-10(16)7-14(13,3)15(12)8-17-15/h6,10-12,16H,4-5,7-8H2,1-3H3/t10-,11-,12-,13+,14-,15+/m1/s1
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Inchikey: ICJDGHMOMSQSLB-LACSLYJWSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C15H22O3
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Molecular weight: 250.33
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Monoisotopic mass: 250.15689456
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Fungi
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Fungi id Species 561 Fusarium sp.