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Rhodoislandin A

  • Formula: C30H18O10

  • Molecular weight: 538.50

  • Smiles: CC1=CC2=C(C(=C1)O)C(=O)C3=C(C=CC(=C3C2=O)C4=C5C(=C(C=C4O)O)C(=O)C6=C(C=C(C(=C6C5=O)O)C)O)O

  • Type: Anthraquinoid dimer

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Rhodoislandin A

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

Names

  • Mycotoxin name: Rhodoislandin A

  • First synonym: None

  • Synonyms: Rhodoislandin A,18783-14-7,DTXSID40172098,DTXCID9094589,1-(4,5-dihydroxy-7-methyl-9,10-dioxoanthracen-1-yl)-2,4,5,8-tetrahydroxy-7-methylanthracene-9,10-dione

Identifiers / External links

  • CAS: 18783-14-7

  • PubChem CID: 5491376

  • DSS TOX CID: DTXCID9094589

  • CompTox Chemicals Dashboard (DTXSID): DTXSID40172098

Structure

  • Smiles: CC1=CC2=C(C(=C1)O)C(=O)C3=C(C=CC(=C3C2=O)C4=C5C(=C(C=C4O)O)C(=O)C6=C(C=C(C(=C6C5=O)O)C)O)O

  • Isomeric smiles: CC1=CC2=C(C(=C1)O)C(=O)C3=C(C=CC(=C3C2=O)C4=C5C(=C(C=C4O)O)C(=O)C6=C(C=C(C(=C6C5=O)O)C)O)O

  • Inchi: InChI=1S/C30H18O10/c1-9-5-12-19(14(32)6-9)28(38)21-13(31)4-3-11(20(21)27(12)37)18-16(34)8-17(35)22-24(18)30(40)25-23(29(22)39)15(33)7-10(2)26(25)36/h3-8,31-36H,1-2H3

  • Inchikey: RDQVRYHIJRVXSO-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H18O10

  • Molecular weight: 538.50

  • Monoisotopic mass: 538.08999677

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