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Trichocarane b

  • Formula: C15H26O3

  • Molecular weight: 254.36

  • Smiles: CC(C)C1(C2CCC(=CCC2(CC1O)C)CO)O

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Trichocarane b

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

  • Mycotoxin name: Trichocarane b

  • First synonym: Trichocarane b

  • Synonyms: TRICHOCARANE B,CHEMBL509591

Identifiers / External links

Structure

  • Smiles: CC(C)C1(C2CCC(=CCC2(CC1O)C)CO)O

  • Isomeric smiles: CC(C)[C@]1([C@@H]2CCC(=CC[C@]2(C[C@@H]1O)C)CO)O

  • Inchi: InChI=1S/C15H26O3/c1-10(2)15(18)12-5-4-11(9-16)6-7-14(12,3)8-13(15)17/h6,10,12-13,16-18H,4-5,7-9H2,1-3H3/t12-,13+,14+,15-/m1/s1

  • Inchikey: OQMGYKWZJSTWIL-CBBWQLFWSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H26O3

  • Molecular weight: 254.36

  • Monoisotopic mass: 254.18819469

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