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Ml 236c

  • Formula: C18H26O3

  • Molecular weight: 290.40

  • Smiles: CC1C=CC2=CCCCC2C1CCC3CC(CC(=O)O3)O

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Ml 236c

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

  • Mycotoxin name: Ml 236c

  • First synonym: Ml-236c

  • Synonyms: ML-236C,ML 236C,58889-18-2,BRN 1588586,(4R,6R)-6-[2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one,Antibiotic ML 236C,CHEBI:34828,DTXSID60207598,2H-Pyran-2-one, 6-(2-(1,2,6,7,8,8a-hexahydro-2-methyl-1-naphthalenyl)ethyl)tetrahydro-4-hydroxy-, (1S-(1-alpha(4S*,6S*),2-alpha,8a-alpha))-,6-(2-(1,2,6,7,8,8a-Hexahydro-2-methyl-1-naphthalenyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one,Q27116289,(4R)-4alpha-Hydroxy-6beta-[2-[(1S)-2beta-methyl-1,2,6,7,8,8abeta-hexahydronaphthalene-1beta-yl]ethyl]tetrahydro-2H-pyran-2-one,(4R,6R)-4-hydroxy-6-{2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}oxan-2-one,(4R,6R)-4-hydroxy-6-{2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}tetrahydro-2H-pyran-2-one

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Structure

  • Smiles: CC1C=CC2=CCCCC2C1CCC3CC(CC(=O)O3)O

  • Isomeric smiles: C[C@H]1C=CC2=CCCC[C@@H]2[C@H]1CC[C@@H]3C[C@H](CC(=O)O3)O

  • Inchi: InChI=1S/C18H26O3/c1-12-6-7-13-4-2-3-5-17(13)16(12)9-8-15-10-14(19)11-18(20)21-15/h4,6-7,12,14-17,19H,2-3,5,8-11H2,1H3/t12-,14+,15+,16-,17-/m0/s1

  • Inchikey: NXIASLUNMKAUTN-WFKFIOEPSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C18H26O3

  • Molecular weight: 290.40

  • Monoisotopic mass: 290.18819469

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