Brasilamide I

AlkaPlorer ID: AK290954

Synonym: None

IUPAC Name: 3-[4-[4-hydroxy-4-(hydroxymethyl)cyclohexyl]-5-oxofuran-2-ylidene]-2-methylpropanamide

Structure

SMILES: CC(C=C1C=C(C2CCC(O)(CO)CC2)C(=O)O1)C(=N)O

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InChI: InChI=1S/C15H21NO5/c1-9(13(16)18)6-11-7-12(14(19)21-11)10-2-4-15(20,8-17)5-3-10/h6-7,9-10,17,20H,2-5,8H2,1H3,(H2,16,18)

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InChIKey: IPIMCZYGNRWKDI-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 295.3349999999999

TPSA: 110.84000000000002

MolLogP: 1.43847

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information