UDP-6-deoxy-5,6-ene-GalNAc

Chemical Formula:

C₁₇H₂₃N₃O₁₆P₂

Molecular Weight:

587.327 Daltons

Monoisotopic Mass:

589.0710047916999 Daltons

SMILES:

C=C3(C(C(C(C(OP(OP(OCC1(C(C(C(O1)N2(C=CC(NC2=O)=O))O)O))([O-])=O)([O-])=O)O3)NC(C)=O)O)O)

InChI:

1S/C17H25N3O16P2/c1-6-11(23)13(25)10(18-7(2)21)16(33-6)35-38(30,31)36-37(28,29)32-5-8-12(24)14(26)15(34-8)20-4-3-9(22)19-17(20)27/h3-4,8,10-16,23-26H,1,5H2,2H3,(H,18,21)(H,28,29)(H,30,31)(H,19,22,27)/p-2/t8-,10-,11+,12-,13-,14-,15-,16-/m1/s1

InChIKey:

BNDFCARCBRBJRX-KFVCKIFFSA-L

Synonyms

UDP-N-[(2S,3R,4R,5R)-2,4,5-trihydroxy-6-methylideneoxan-3-yl]acetamide

Databases

MetaCyc: CPD-19361

ChEBI: 85718

PubChem (CID): 91825682

MetaNetX: MNXM161999