Chaetomugilin o

  • Formula: C23H25ClO5

  • Molecular weight: 416.90

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

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Chaetomugilin o

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

  • Mycotoxin name: Chaetomugilin o

  • First synonym: Chaetoviridin g

  • Synonyms: Chaetoviridin G,Chaetomugilin O,CHEBI:67619,CHEMBL1802158,Q27136086,(6aS,9R,9aS)-5-chloro-6a-methyl-9-[(2E)-2-methylbut-2-enoyl]-3-[(1E,3S)-3-methylpent-1-en-1-yl]-9,9a-dihydro-6H-furo[2,3-h]isochromene-6,8(6aH)-dione

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Structure

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

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

  • Inchi: InChI=1S/C23H25ClO5/c1-6-12(3)8-9-14-10-15-16(11-28-14)18-17(20(25)13(4)7-2)22(27)29-23(18,5)21(26)19(15)24/h7-12,17-18H,6H2,1-5H3/b9-8+,13-7+/t12-,17+,18+,23-/m0/s1

  • Inchikey: GFTHCZMPYKVNIC-GETGECRZSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H25ClO5

  • Molecular weight: 416.90

  • Monoisotopic mass: 416.1390516

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