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Sch 60057

  • Formula: C45H84O6

  • Molecular weight: 721.10

  • Smiles: CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(=CCCC(=CCCC(=CCO)C)C)C)O)O)O)O)O)C

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Sch 60057

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
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Names

  • Mycotoxin name: Sch 60057

  • First synonym: Sch-60057

  • Synonyms: Sch-60057,203061-35-2,(2E,6E,10E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,34-tetraene-1,15,19,23,27,31-hexol,3,7,11,15,19,23,27,31,35-nonamethyl-2E,6E,10E,34-hexatriacontatetraene-1,15,19,23,27,31-hexol,SCH 60057,BS-1387,MCULE-5100877792,NCGC00384699-01!(2E,6E,10E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,34-tetraene-1,15,19,23,27,31-hexol

Identifiers / External links

  • CAS: 203061-35-2

  • PubChem CID: 9918271

  • Chemical Entities of Biological Interest (CHEBI): CHEBI:211681

Structure

  • Smiles: CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(=CCCC(=CCCC(=CCO)C)C)C)O)O)O)O)O)C

  • Isomeric smiles: CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCC/C(=C/CC/C(=C/CC/C(=C/CO)/C)/C)/C)O)O)O)O)O)C

  • Inchi: InChI=1S/C45H84O6/c1-37(2)19-13-26-41(6,47)28-15-30-43(8,49)32-17-34-45(10,51)35-18-33-44(9,50)31-16-29-42(7,48)27-14-24-39(4)22-11-20-38(3)21-12-23-40(5)25-36-46/h19,21-22,25,46-51H,11-18,20,23-24,26-36H2,1-10H3/b38-21+,39-22+,40-25+

  • Inchikey: LZPKHIWZLREKGD-VEXHCKPKSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C45H84O6

  • Molecular weight: 721.10

  • Monoisotopic mass: 720.62679039

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