Nikkomycin So(Z)

AlkaPlorer ID: AK019891

Synonym: 'Nikkomycin So(Z)'

IUPAC Name: (2R,3R,5S,6S,7R)-2-(2,4-dioxopyrimidin-1-yl)-3,6,7-trihydroxy-3,3a,5,6,7,7a-hexahydro-2H-furo[3,2-b]pyran-5-carboxylic acid

Structure

SMILES: O=C(O)[C@H]1OC2C(O[C@@H](N3C=CC(O)=NC3=O)[C@@H]2O)[C@H](O)[C@@H]1O

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InChI: InChI=1S/C12H14N2O9/c15-3-1-2-14(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,19,20)(H,13,15,21)/t4-,5+,6-,7?,8?,9+,10-/m1/s1

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InChIKey: AASHGHDGOQHZOR-XCUGXOTESA-N

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Source

Properties Information

Molecule Weight: 330.249

TPSA: 171.56999999999996

MolLogP: -3.219

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