Nikkomycin So(X)

AlkaPlorer ID: AK021144

Synonym: 'Nikkomycin So(x)', 'Nikkomycin So(X)'

IUPAC Name: (2R,3R,5S,6S,7R)-2-(5-formyl-2-oxo-1H-imidazol-3-yl)-3,6,7-trihydroxy-3,3a,5,6,7,7a-hexahydro-2H-furo[3,2-b]pyran-5-carboxylic acid

Structure

SMILES: O=CC1=CN([C@@H]2OC3C(O[C@H](C(=O)O)[C@@H](O)[C@H]3O)[C@H]2O)C(O)=N1

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InChI: InChI=1S/C12H14N2O9/c15-2-3-1-14(12(21)13-3)10-6(18)8-7(23-10)4(16)5(17)9(22-8)11(19)20/h1-2,4-10,16-18H,(H,13,21)(H,19,20)/t4-,5+,6-,7?,8?,9+,10-/m1/s1

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InChIKey: MCEHHDMQJDREQZ-XCUGXOTESA-N

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Source

Properties Information

Molecule Weight: 330.249

TPSA: 171.57

MolLogP: -2.7667

Number of H-Donors: 5

Number of H-Acceptors: 10

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information