Logo Anses
Logo Interreg

Sequoiamonascin b

  • Formula: C23H30O7

  • Molecular weight: 418.50

  • Smiles: CCCCCCCC(C1C2CC3=C(COC4(C3)C=CC(=O)O4)C(=O)C2(OC1=O)C)O

Download

Sequoiamonascin b

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

Names

  • Mycotoxin name: Sequoiamonascin b

  • First synonym: Sequoiamonascin b

  • Synonyms: Sequoiamonascin B

Identifiers / External links

Structure

  • Smiles: CCCCCCCC(C1C2CC3=C(COC4(C3)C=CC(=O)O4)C(=O)C2(OC1=O)C)O

  • Isomeric smiles: CCCCCCCC([C@@H]1[C@H]2CC3=C(CO[C@]4(C3)C=CC(=O)O4)C(=O)[C@@]2(OC1=O)C)O

  • Inchi: InChI=1S/C23H30O7/c1-3-4-5-6-7-8-17(24)19-16-11-14-12-23(10-9-18(25)29-23)28-13-15(14)20(26)22(16,2)30-21(19)27/h9-10,16-17,19,24H,3-8,11-13H2,1-2H3/t16-,17?,19+,22-,23-/m1/s1

  • Inchikey: IWTQEDJIBDRKRZ-OYFJEQRESA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H30O7

  • Molecular weight: 418.50

  • Monoisotopic mass: 418.19915329

Select an endpoint:

Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Sub category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Endpoint Tool Value Unit Comments Reference

Fungi