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De-o-methyldihydrosterigmatocystin

  • Formula: C17H12O6

  • Molecular weight: 312.27

  • Smiles: C1COC2C1C3=C(O2)C=C(C4=C3OC5=CC=CC(=C5C4=O)O)O

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De-o-methyldihydrosterigmatocystin

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

  • Mycotoxin name: De-o-methyldihydrosterigmatocystin

  • First synonym: De-o-methyldihydrosterigmatocystin

  • Synonyms: De-O-methyldihydrosterigmatocystin,DTXSID90952827,CHEBI:174245,6,8-Dihydroxy-1,2,3a,12c-tetrahydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one,11,15-dihydroxy-6,8,20-trioxapentacyclo[10.8.0.0^{2,9}.0^{3,7}.0^{14,19}]icosa-1,9,11,14,16,18-hexaen-13-one,11,15-dihydroxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1(12),2(9),10,14,16,18-hexaen-13-one

Identifiers / External links

Structure

  • Smiles: C1COC2C1C3=C(O2)C=C(C4=C3OC5=CC=CC(=C5C4=O)O)O

  • Isomeric smiles: C1COC2C1C3=C(O2)C=C(C4=C3OC5=CC=CC(=C5C4=O)O)O

  • Inchi: InChI=1S/C17H12O6/c18-8-2-1-3-10-13(8)15(20)14-9(19)6-11-12(16(14)22-10)7-4-5-21-17(7)23-11/h1-3,6-7,17-19H,4-5H2

  • Inchikey: WUSMTEDKVPWFDN-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C17H12O6

  • Molecular weight: 312.27

  • Monoisotopic mass: 312.0633881

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