Chaetoviridin i

  • Formula: C23H27ClO8

  • Molecular weight: 466.90

  • Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C4(C2(C(O1)OC(=C4C(=O)O3)C(C)C(C)O)O)O)C)Cl

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Chaetoviridin i

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

  • Mycotoxin name: Chaetoviridin i

  • First synonym: Chaetoviridin i

  • Synonyms: Chaetoviridin I,CHEBI:67621,CHEMBL1802160,Q27136088,(9aS)-8-chloro-9b,9c-dihydroxy-3-(3-hydroxybutan-2-yl)-9a-methyl-6-[(1E,3S)-3-methylpent-1-en-1-yl]-4a,9a,9b,9c-tetrahydro-2H,9H-furo[4,3,2-de]pyrano[4,3,2-ij]isochromene-2,9-dione

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Structure

  • Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C4(C2(C(O1)OC(=C4C(=O)O3)C(C)C(C)O)O)O)C)Cl

  • Isomeric smiles: CC[C@H](C)/C=C/C1=CC2=C(C(=O)[C@@]3(C4(C2(C(O1)OC(=C4C(=O)O3)C(C)C(C)O)O)O)C)Cl

  • Inchi: InChI=1S/C23H27ClO8/c1-6-10(2)7-8-13-9-14-16(24)18(26)21(5)23(29)15(19(27)32-21)17(11(3)12(4)25)31-20(30-13)22(14,23)28/h7-12,20,25,28-29H,6H2,1-5H3/b8-7+/t10-,11?,12?,20?,21+,22?,23?/m0/s1

  • Inchikey: MYEDOZFFLHARPQ-MDJFZDGJSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H27ClO8

  • Molecular weight: 466.90

  • Monoisotopic mass: 466.1394455

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