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Fumiquinazoline I

  • Formula: C27H29N5O4

  • Molecular weight: 487.50

  • Smiles: CC1C2=NC3=CC=CC=C3C(=O)N2C(C(=O)N1)CC4(C5NC(C(=O)N5C6=CC=CC=C64)CC(C)C)O

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Fumiquinazoline I

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

Names

  • Mycotoxin name: Fumiquinazoline I

  • First synonym: None

  • Synonyms: Fumiquinazoline I,(1S,4R)-4-[[(2S,3aR,4R)-4-hydroxy-2-(2-methylpropyl)-1-oxo-3,3a-dihydro-2H-imidazo[1,2-a]indol-4-yl]methyl]-1-methyl-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione,278184-56-8,CHEBI:199827,DTXSID101017938

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Structure

  • Smiles: CC1C2=NC3=CC=CC=C3C(=O)N2C(C(=O)N1)CC4(C5NC(C(=O)N5C6=CC=CC=C64)CC(C)C)O

  • Isomeric smiles: C[C@H]1C2=NC3=CC=CC=C3C(=O)N2[C@@H](C(=O)N1)C[C@@]4([C@@H]5N[C@H](C(=O)N5C6=CC=CC=C64)CC(C)C)O

  • Inchi: InChI=1S/C27H29N5O4/c1-14(2)12-19-25(35)32-20-11-7-5-9-17(20)27(36,26(32)30-19)13-21-23(33)28-15(3)22-29-18-10-6-4-8-16(18)24(34)31(21)22/h4-11,14-15,19,21,26,30,36H,12-13H2,1-3H3,(H,28,33)/t15-,19-,21+,26+,27+/m0/s1

  • Inchikey: XQIGVMVJGPFNDE-YGHANTCSSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C27H29N5O4

  • Molecular weight: 487.50

  • Monoisotopic mass: 487.22195442

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