Sparsomycin

AlkaPlorer ID: AK570391

Synonym: None

IUPAC Name: (E)-N-[1-hydroxy-3-[(R)-methylsulfanylmethylsulfinyl]propan-2-yl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide

Structure

SMILES: CSC[S@+]([O-])CC(CO)N=C(O)/C=C/C1=C(C)N=C(O)N=C1O

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InChI: InChI=1S/C13H19N3O5S2/c1-8-10(12(19)16-13(20)14-8)3-4-11(18)15-9(5-17)6-23(21)7-22-2/h3-4,9,17H,5-7H2,1-2H3,(H,15,18)(H2,14,16,19,20)/b4-3+/t9?,23-/m1/s1

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InChIKey: XKLZIVIOZDNKEQ-FBKVPXSSSA-N

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Properties Information

Molecule Weight: 361.4450000000001

TPSA: 142.12

MolLogP: 0.5960199999999998

Number of H-Donors: 4

Number of H-Acceptors: 8

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information