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TmC-169

  • Formula: C24H35NO3

  • Molecular weight: 385.50

  • Smiles: CC1C2C(NC(=O)C23C(C=C(CCCC(C=CC3=O)O)C)C=C1C)CC(C)C

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TmC-169

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

  • Mycotoxin name: TmC-169

  • First synonym: Tmc-169

  • Synonyms: TMC-169,UNII-R55SU7FW27,R55SU7FW27,CHEMBL472639,ACon0_000449,TMC 169,J1.138.912K,(3S,13E,19E)-14-Methyl-3-isobutyl-18-hydroxy-10-nor(11)cytochalasa-6,13,19-triene-1,21-dione,1H-Cycloundec(d)isoindole-1,15(2H)-dione, 3,3a,4,6a,9,10,11,12-octahydro-12-hydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-, (3S,3aR,4S,6aS,7E,13E,15aS)-,242147-94-0

Identifiers / External links

Structure

  • Smiles: CC1C2C(NC(=O)C23C(C=C(CCCC(C=CC3=O)O)C)C=C1C)CC(C)C

  • Isomeric smiles: C[C@H]1[C@H]2[C@@H](NC(=O)[C@@]23[C@@H](/C=C(/CCCC(/C=C/C3=O)O)\C)C=C1C)CC(C)C

  • Inchi: InChI=1S/C24H35NO3/c1-14(2)11-20-22-17(5)16(4)13-18-12-15(3)7-6-8-19(26)9-10-21(27)24(18,22)23(28)25-20/h9-10,12-14,17-20,22,26H,6-8,11H2,1-5H3,(H,25,28)/b10-9+,15-12+/t17-,18+,19?,20+,22+,24-/m1/s1

  • Inchikey: PBMWGTZJDVBFGK-YJEZAUDRSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C24H35NO3

  • Molecular weight: 385.50

  • Monoisotopic mass: 385.26169398

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