Logo Anses
Logo Interreg

Fusarielin b

  • Formula: C25H40O5

  • Molecular weight: 420.60

  • Smiles: CC=C(C)C1C(C2CC(C(CC2C3C1(O3)C)(C)O)O)C=CC=C(C)C(C(C)CO)O

Download

Fusarielin b

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

Names

  • Mycotoxin name: Fusarielin b

  • First synonym: Fusarielin b

  • Synonyms: fusarielin B,CHEMBL228495

Identifiers / External links

Structure

  • Smiles: CC=C(C)C1C(C2CC(C(CC2C3C1(O3)C)(C)O)O)C=CC=C(C)C(C(C)CO)O

  • Isomeric smiles: C/C=C(\C)/[C@H]1[C@H]([C@@H]2C[C@H]([C@](C[C@H]2[C@H]3[C@@]1(O3)C)(C)O)O)/C=C/C=C(\C)/[C@H]([C@@H](C)CO)O

  • Inchi: InChI=1S/C25H40O5/c1-7-14(2)21-17(10-8-9-15(3)22(28)16(4)13-26)18-11-20(27)24(5,29)12-19(18)23-25(21,6)30-23/h7-10,16-23,26-29H,11-13H2,1-6H3/b10-8+,14-7+,15-9+/t16-,17-,18-,19+,20+,21-,22+,23-,24+,25+/m0/s1

  • Inchikey: NJULGUREPHOGBR-RGIDNKBKSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C25H40O5

  • Molecular weight: 420.60

  • Monoisotopic mass: 420.28757437

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