12beta-hydroxychaetoviridin c

  • Formula: C23H27ClO7

  • Molecular weight: 450.90

  • Smiles: CC(C=CC1=CC2=C(C(=O)C3(C(C2=CO1)C(C(=O)O3)C(=O)C(C)C(C)O)C)Cl)C(C)O

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12beta-hydroxychaetoviridin c

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

Names

  • Mycotoxin name: 12beta-hydroxychaetoviridin c

  • First synonym: 12beta-hydroxychaetoviridin c

  • Synonyms: 12Beta-Hydroxychaetoviridin C,CHEBI:67618,CHEMBL1802157,Q27136085,rel-(6aS,9R,9aS)-5-chloro-9-[(2S,3S)-3-hydroxy-2-methylbutanoyl]-3-[(1E,3R,4R)-4-hydroxy-3-methylpent-1-en-1-yl]-6a-methyl-9,9a-dihydro-6H-furo[2,3-h]isochromene-6,8(6aH)-dione

Identifiers / External links

Structure

  • Smiles: CC(C=CC1=CC2=C(C(=O)C3(C(C2=CO1)C(C(=O)O3)C(=O)C(C)C(C)O)C)Cl)C(C)O

  • Isomeric smiles: C[C@H](/C=C/C1=CC2=C(C(=O)[C@@]3([C@H](C2=CO1)[C@@H](C(=O)O3)C(=O)[C@@H](C)[C@H](C)O)C)Cl)[C@@H](C)O

  • Inchi: InChI=1S/C23H27ClO7/c1-10(12(3)25)6-7-14-8-15-16(9-30-14)18-17(20(27)11(2)13(4)26)22(29)31-23(18,5)21(28)19(15)24/h6-13,17-18,25-26H,1-5H3/b7-6+/t10-,11+,12-,13+,17-,18-,23+/m1/s1

  • Inchikey: MEPQPODJTXSHEP-HETSEVKPSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H27ClO7

  • Molecular weight: 450.90

  • Monoisotopic mass: 450.1445309

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