CDP-4-dehydro-3,6-dideoxy-α-D-glucose

Chemical Formula:

C₁₅H₂₁N₃O₁₄P₂

Molecular Weight:

529.29 Daltons

Monoisotopic Mass:

531.0655254832999 Daltons

SMILES:

CC1(OC(C(CC1=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/C15H23N3O14P2/c1-6-7(19)4-8(20)14(29-6)31-34(26,27)32-33(24,25)28-5-9-11(21)12(22)13(30-9)18-3-2-10(16)17-15(18)23/h2-3,6,8-9,11-14,20-22H,4-5H2,1H3,(H,24,25)(H,26,27)(H2,16,17,23)/p-2/t6-,8-,9-,11-,12-,13-,14-/m1/s1

InChIKey:

DATWFRMXXZBEPM-SNAICPSHSA-L

Synonyms

CDP-3,6-dideoxy-D-glycero-D-glycero-4-hexulose
CDP-4-keto-3,6-dideoxy-D-xylo--4-hexulose

Databases

MetaCyc: CPD-1078

ChEBI: 70783

PubChem (CID): 25245089

KEGG: C04297

Seed: cpd02638

MetaNetX: MNXM4514