Logo Anses
Logo Interreg

Communesin j

  • Formula: C32H36N4O

  • Molecular weight: 492.70

  • Smiles: CC=CC=CC(=O)N1CCC23C1N4CCC25C(NC6=CC=CC=C36)N(C7=CC=CC(=C57)C4C=C(C)C)C

Download

Communesin j

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

Names

  • Mycotoxin name: Communesin j

  • First synonym: Communesin j

  • Synonyms: Communesin J

Identifiers / External links

Structure

  • Smiles: CC=CC=CC(=O)N1CCC23C1N4CCC25C(NC6=CC=CC=C36)N(C7=CC=CC(=C57)C4C=C(C)C)C

  • Isomeric smiles: C/C=C/C=C/C(=O)N1CC[C@]23[C@H]1N4CC[C@]25[C@H](NC6=CC=CC=C36)N(C7=CC=CC(=C57)[C@H]4C=C(C)C)C

  • Inchi: InChI=1S/C32H36N4O/c1-5-6-7-15-27(37)36-19-16-31-23-12-8-9-13-24(23)33-29-32(31)17-18-35(30(31)36)26(20-21(2)3)22-11-10-14-25(28(22)32)34(29)4/h5-15,20,26,29-30,33H,16-19H2,1-4H3/b6-5+,15-7+/t26-,29-,30+,31+,32+/m1/s1

  • Inchikey: IQVIOXLNMXZRPP-MCNCHUQJSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C32H36N4O

  • Molecular weight: 492.70

  • Monoisotopic mass: 492.28891178

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