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Rks-1778

  • Formula: C30H39NO4

  • Molecular weight: 477.60

  • Smiles: CC1CC=CC2C=C(C(C3C2(C(C=CC(C1)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)C

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Rks-1778

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

  • Mycotoxin name: Rks-1778

  • First synonym: Rks-1778

  • Synonyms: RKS-1778,CHEMBL517485

Identifiers / External links

Structure

  • Smiles: CC1CC=CC2C=C(C(C3C2(C(C=CC(C1)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)C

  • Isomeric smiles: C[C@H]1C/C=C/[C@H]2C=C([C@H]([C@@H]3[C@@]2([C@@H](/C=C/[C@](C1)(C)O)OC(=O)C)C(=O)N[C@H]3CC4=CC=CC=C4)C)C

  • Inchi: InChI=1S/C30H39NO4/c1-19-10-9-13-24-16-20(2)21(3)27-25(17-23-11-7-6-8-12-23)31-28(33)30(24,27)26(35-22(4)32)14-15-29(5,34)18-19/h6-9,11-16,19,21,24-27,34H,10,17-18H2,1-5H3,(H,31,33)/b13-9+,15-14+/t19-,21+,24-,25-,26+,27-,29-,30+/m0/s1

  • Inchikey: LYHWACCLUSDGME-HTGZJUKKSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H39NO4

  • Molecular weight: 477.60

  • Monoisotopic mass: 477.28790873

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