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Aspochalasin k

  • Formula: C25H39NO5

  • Molecular weight: 433.60

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

  • Type: Cytochalasan

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Aspochalasin k

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

Names

  • Mycotoxin name: Aspochalasin k

  • First synonym: Unii-shj7wv7e5g

  • Synonyms: UNII-SHJ7WV7E5G,SHJ7WV7E5G,ASPOCHALASIN K,J2.030.312C,10-Isopropyl-14-methyl-17,19-dihydroxy-18-methoxy(11)cytochalasa-6,13-diene-1,21-dione,1H-Cycloundec(d)isoindole-1,15(2H)-dione, 3,3a,4,6a,9,10,11,12,13,14-decahydro-11,13-dihydroxy-12-methoxy-4,5,8-trimethyl-3-(2-methylpropyl)-, (3S,3aR,4S,6aS,7E,15aS)-,670225-71-5

Identifiers / External links

Structure

  • Smiles: CC1C2C(NC(=O)C23C(C=C(CCC(C(C(CC3=O)O)OC)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(/CCC(C(C(CC3=O)O)OC)O)\C)C=C1C)CC(C)C

  • Inchi: InChI=1S/C25H39NO5/c1-13(2)9-18-22-16(5)15(4)11-17-10-14(3)7-8-19(27)23(31-6)20(28)12-21(29)25(17,22)24(30)26-18/h10-11,13,16-20,22-23,27-28H,7-9,12H2,1-6H3,(H,26,30)/b14-10+/t16-,17+,18+,19?,20?,22+,23?,25-/m1/s1

  • Inchikey: VDFBOYQHOXIVOC-ZVMWUMDVSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C25H39NO5

  • Molecular weight: 433.60

  • Monoisotopic mass: 433.28282334

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