CDP-4-dehydro-6-deoxy-α-D-glucose

Chemical Formula:

C₁₅H₂₁N₃O₁₅P₂

Molecular Weight:

545.289 Daltons

Monoisotopic Mass:

547.0604401054 Daltons

SMILES:

CC1(OC(C(C(C1=O)O)O)OP([O-])(=O)OP(OCC3(C(C(C(N2(C(N=C(C=C2)N)=O))O3)O)O))([O-])=O)

InChI:

1S/C15H23N3O15P2/c1-5-8(19)10(21)12(23)14(30-5)32-35(27,28)33-34(25,26)29-4-6-9(20)11(22)13(31-6)18-3-2-7(16)17-15(18)24/h2-3,5-6,9-14,20-23H,4H2,1H3,(H,25,26)(H,27,28)(H2,16,17,24)/p-2/t5-,6-,9-,10+,11-,12-,13-,14-/m1/s1

InChIKey:

PUBYMNIINUUJLL-JPHISPRKSA-L

Synonyms

CDP-6-deoxy-D-glycero-L-threo-4-hexulose
CDP-4-keto-6-deoxy-D-xylo-4-hexulose

Databases

MetaCyc: CPD-658

ChEBI: 138808

PubChem (CID): 25244744

KEGG: C01219

Seed: cpd00897

MetaNetX: MNXM1370