Brasilamide A

AlkaPlorer ID: AK067831

Synonym: None

IUPAC Name: (E)-5-[(1R,2S,5R,6S,7S)-5-hydroxy-6-methyl-3-oxo-4-oxatricyclo[3.3.1.02,7]nonan-2-yl]-2-methyl-4-oxopent-2-enamide

Structure

SMILES: C/C(=C\C(=O)C[C@]12C(=O)O[C@]3(O)C[C@H]1C[C@H]2[C@@H]3C)C(=N)O

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InChI: InChI=1S/C15H19NO5/c1-7(12(16)18)3-10(17)6-14-9-4-11(14)8(2)15(20,5-9)21-13(14)19/h3,8-9,11,20H,4-6H2,1-2H3,(H2,16,18)/b7-3+/t8-,9+,11-,14-,15+/m0/s1

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InChIKey: OVGVAJKXQUOAJE-QQOLQFCFSA-N

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Properties Information

Molecule Weight: 293.319

TPSA: 107.68000000000002

MolLogP: 1.33487

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information