Bluensomycin

Molecular Formula: C21H45N5O20S


InChI: InChI=1/C19H35NO14.CH5N3.CH3NO2.H2O4S/c1-5-19(30,4-22)16(34-17-7(20-2)9(24)8(23)6(3-21)32-17)18(31-5)33-15-13(28)11(26)10(25)12(27)14(15)29;2*2-1(3)4;1-5(2,3)4/h5-18,20-30H,3-4H2,1-2H3;(H5,2,3,4);2H2,(H,3,4);(H2,1,2,3,4)/f/h;2H,3-4H2;3H;1-2H

InChIKey: InChIKey=WTQVKIMUXFERGB-GUNWOQPSCJ
SMILES: CC1C(C(C(O1)OC2C(C(C(C(C2O)O)O)O)O)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O.C(=N)(N)N.C(=O)(N)O.OS(=O)(=O)O

Names:
    Bluensomycin
    carbamic acid; 6-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-methylamino-oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyl-oxolan-2-yl]oxycyclohexane-1,2,3,4,5-pentol; guanidine; sulfuric acid
    NSC111930

Registries:
    PubChem CID 270021
    PubChem ID 8140034