ADP-D-glycero-D-manno-heptose

Molecular Formula: C17H27N5O16P2


InChI: InChI=1/C17H27N5O16P2/c18-14-7-15(20-3-19-14)22(4-21-7)16-11(28)8(25)6(35-16)2-34-39(30,31)38-40(32,33)37-17-12(29)9(26)10(27)13(36-17)5(24)1-23/h3-6,8-13,16-17,23-29H,1-2H2,(H,30,31)(H,32,33)(H2,18,19,20)/t5-,6-,8-,9+,10+,11-,12+,13-,16-,17?/m1/s1/f/h30,32H,18H2

InChIKey: InChIKey=KMSFWBYFWSKGGR-OCMKDDBBDE
SMILES: [H][C@@]1(OC(OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n3cnc4c(N)ncnc34)[C@@H](O)[C@@H](O)[C@@H]1O)[C@H](O)CO

Names:
    adenine 5'-[3-(D-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate]
    ADP-D-glycero-D-manno-heptose
    CHEBI:16693
    [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxy-oxan-2-yl]oxy-phosphinic acid

Registries:
    PubChem CID 441006
    ChEBI 16693
    Kegg C06397
    PubChem ID 11533185
    PubChem ID 8633