Verrucarin m

  • Formula: C27H32O9

  • Molecular weight: 500.50

  • Smiles: CC1=CC2C3(CC1)COC(=O)C=C(CCOC(=O)C=CC=CC(=O)OC4C3(C5(CO5)C(C4O)O2)C)C

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Verrucarin m

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

Names

  • Mycotoxin name: Verrucarin m

  • First synonym: Verrucarin m

  • Synonyms: Verrucarin M

Identifiers / External links

Structure

  • Smiles: CC1=CC2C3(CC1)COC(=O)C=C(CCOC(=O)C=CC=CC(=O)OC4C3(C5(CO5)C(C4O)O2)C)C

  • Isomeric smiles: CC1=C[C@@H]2[C@@]3(CC1)COC(=O)/C=C(CCOC(=O)/C=C/C=C/C(=O)O[C@@H]4[C@@]3([C@]5(CO5)[C@@H](C4O)O2)C)/C

  • Inchi: InChI=1S/C27H32O9/c1-16-8-10-26-14-33-21(30)13-17(2)9-11-32-19(28)6-4-5-7-20(29)36-23-22(31)24(35-18(26)12-16)27(15-34-27)25(23,26)3/h4-7,12-13,18,22-24,31H,8-11,14-15H2,1-3H3/b6-4+,7-5+,17-13-/t18-,22?,23+,24-,25+,26-,27+/m1/s1

  • Inchikey: SBDCDLYTQBGFRK-LUXGIOSZSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C27H32O9

  • Molecular weight: 500.50

  • Monoisotopic mass: 500.20463259

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