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Wentilactone b

  • Formula: C16H18O5

  • Molecular weight: 290.31

  • Smiles: CC12CC(CC3(C1C(C=C4C2=CC(=O)OC4)OC3=O)C)O

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Wentilactone b

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

Names

  • Mycotoxin name: Wentilactone b

  • First synonym: Unii-8jti620gsi

  • Synonyms: UNII-8JTI620GSI,Wentilactone B,8JTI620GSI,76236-26-5,(1S,9R,12S,14R,16R)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione,DTXSID80997580,Q27270644,2-Hydroxy-3a,10b-dimethyl-1,2,3,3a,5a,7,10b,10c-octahydro-4H,9H-furo[2',3',4':4,5]naphtho[2,1-c]pyran-4,9-dione,4H,9H-Furo(2',3',4':4,5)naphtho(2,1-c)pyran-4,9-dione,1,2,3,3a,5a,7,10b,10c-octahydro-2-hydroxy-3a,10b-dimethyl-, (2R,3aS,5aR,10bS,10cR)-

Identifiers / External links

Structure

  • Smiles: CC12CC(CC3(C1C(C=C4C2=CC(=O)OC4)OC3=O)C)O

  • Isomeric smiles: C[C@]12C[C@H](C[C@]3([C@@H]1[C@@H](C=C4C2=CC(=O)OC4)OC3=O)C)O

  • Inchi: InChI=1S/C16H18O5/c1-15-5-9(17)6-16(2)13(15)11(21-14(16)19)3-8-7-20-12(18)4-10(8)15/h3-4,9,11,13,17H,5-7H2,1-2H3/t9-,11-,13-,15-,16+/m1/s1

  • Inchikey: NQUNKSRIHYKOIX-QFLIJWGCSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H18O5

  • Molecular weight: 290.31

  • Monoisotopic mass: 290.11542367

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