Logo Anses
Logo Interreg

Pc-m5'

  • Formula: C29H37NO5

  • Molecular weight: 479.60

  • Smiles: CC(=O)OC1C=C2C(CCC3(C2(CCC4C3(C5=C(C4)C6=CC=CC=C6N5)C)O)C)OC1C(C)(C)O

Download

Pc-m5'

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

Names

  • Mycotoxin name: Pc-m5'

  • First synonym: Pc-m5'

  • Synonyms: PC-M5',PC-M-5',CHEBI:176165,MCULE-5545056085,NCGC00386061-01,[(1S,2R,5S,7S,8R,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-yl] acetate

Identifiers / External links

Structure

  • Smiles: CC(=O)OC1C=C2C(CCC3(C2(CCC4C3(C5=C(C4)C6=CC=CC=C6N5)C)O)C)OC1C(C)(C)O

  • Isomeric smiles: CC(=O)O[C@@H]1C=C2[C@H](CC[C@]3([C@]2(CC[C@@H]4[C@@]3(C5=C(C4)C6=CC=CC=C6N5)C)O)C)O[C@@H]1C(C)(C)O

  • Inchi: InChI=1S/C29H37NO5/c1-16(31)34-23-15-20-22(35-25(23)26(2,3)32)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,22-23,25,30,32-33H,10-14H2,1-5H3/t17-,22-,23+,25-,27+,28+,29+/m0/s1

  • Inchikey: IMABPJDBODVJSN-HKZMUHMQSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C29H37NO5

  • Molecular weight: 479.60

  • Monoisotopic mass: 479.26717328

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