Rubellin d

  • Formula: C30H22O10

  • Molecular weight: 542.50

  • Smiles: CC1=CC2=C(C(=C1)O)C(=O)OC2C34CC5=CC(=C6C(=C5C3C=CC(C4O)O)C(=O)C7=C(C=CC(=C7C6=O)O)O)O

Download

Rubellin d

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

Names

  • Mycotoxin name: Rubellin d

  • First synonym: Rubellin d

  • Synonyms: Rubellin D, UNII-5472451653, 121325-49-3, (+)-Rubellin D, Rubellin D, (+)-, DTXSID301017603, Q27231277, 5H-Indeno(1,2-a)anthracene-5,13(8H)-dione, 8a-((1R)-1,3-dihydro-4-hydroxy-6-methyl-3-oxo-1-isobenzofuranyl)-8a,9,10,12a-tetrahydro-1,4,6,9,10-pentahydroxy-, (8aS,9R,10S,12aS)-rel-(+)-

Identifiers / External links

Structure

  • Smiles: CC1=CC2=C(C(=C1)O)C(=O)OC2C34CC5=CC(=C6C(=C5C3C=CC(C4O)O)C(=O)C7=C(C=CC(=C7C6=O)O)O)O

  • Isomeric smiles: CC1=CC2=C(C(=C1)O)C(=O)O[C@@H]2[C@]34CC5=CC(=C6C(=C5[C@H]3C=C[C@H]([C@H]4O)O)C(=O)C7=C(C=CC(=C7C6=O)O)O)O

  • Inchi: InChI=1S/C30H22O10/c1-10-6-12-20(17(34)7-10)29(39)40-28(12)30-9-11-8-18(35)23-24(19(11)13(30)2-3-16(33)27(30)38)26(37)22-15(32)5-4-14(31)21(22)25(23)36/h2-8,13,16,27-28,31-35,38H,9H2,1H3/t13-,16-,27-,28+,30-/m1/s1

  • Inchikey: PPESFXQGSSHUFR-WVZQVMSVSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H22O10

  • Molecular weight: 542.50

  • Monoisotopic mass: 542.12129689

Select an endpoint:

Select an endpoint:

Select an endpoint:

Select an endpoint:

Fungi