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Rubellin e

  • Formula: C30H24O11

  • Molecular weight: 560.50

  • Smiles: CC1=CC(=C(C(=C1)O)C(=O)O)C(C23CC4=CC(=C5C(=C4C2C=CC(C3O)O)C(=O)C6=C(C=CC(=C6C5=O)O)O)O)O

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Rubellin e

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

Names

  • Mycotoxin name: Rubellin e

  • First synonym: Rubellin e

  • Synonyms: Rubellin E

Identifiers / External links

Structure

  • Smiles: CC1=CC(=C(C(=C1)O)C(=O)O)C(C23CC4=CC(=C5C(=C4C2C=CC(C3O)O)C(=O)C6=C(C=CC(=C6C5=O)O)O)O)O

  • Isomeric smiles: CC1=CC(=C(C(=C1)O)C(=O)O)[C@@H]([C@]23CC4=CC(=C5C(=C4[C@H]2C=C[C@H]([C@H]3O)O)C(=O)C6=C(C=CC(=C6C5=O)O)O)O)O

  • Inchi: InChI=1S/C30H24O11/c1-10-6-12(20(29(40)41)17(34)7-10)27(38)30-9-11-8-18(35)23-24(19(11)13(30)2-3-16(33)28(30)39)26(37)22-15(32)5-4-14(31)21(22)25(23)36/h2-8,13,16,27-28,31-35,38-39H,9H2,1H3,(H,40,41)/t13-,16-,27+,28-,30+/m1/s1

  • Inchikey: GMHYAMBYOJNKBN-PJQIVZKYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H24O11

  • Molecular weight: 560.50

  • Monoisotopic mass: 560.13186158

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