2-GDP-[(2S,3S,6R)-5-amino-6-methyl-3,6-dihydro-2H-pyran-3-ol]

Chemical Formula:

C₁₆H₂₂N₆O₁₃P₂

Molecular Weight:

568.33 Daltons

Monoisotopic Mass:

570.0876579088999 Daltons

SMILES:

CC4(C(=CC(C(OP(OP(OCC3(C(C(C(N2(C1(=C(C(NC(=N1)N)=O)N=C2)))O3)O)O))([O-])=O)([O-])=O)O4)O)N)

InChI:

1S/C16H24N6O13P2/c1-5-6(17)2-7(23)15(32-5)34-37(29,30)35-36(27,28)31-3-8-10(24)11(25)14(33-8)22-4-19-9-12(22)20-16(18)21-13(9)26/h2,4-5,7-8,10-11,14-15,23-25H,3,17H2,1H3,(H,27,28)(H,29,30)(H3,18,20,21,26)/p-2/t5-,7+,8-,10-,11-,14-,15-/m1/s1

InChIKey:

BUODSFMRSSLUIZ-FFJBUIDMSA-L

Databases

MetaCyc: CPD-16407

ChEBI: 131636

PubChem (CID): 90658765 135921682

MetaNetX: MNXM148253