(Rib-ol)-P-Glc-AATGal-PP-undecaprenol

Chemical Formula:

C₇₄H₁₂₅N₂O₂₂P₃

Molecular Weight:

1487.723 Daltons

Monoisotopic Mass:

1489.8171583354 Daltons

SMILES:

CC(C)=CCCC(C)=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)([O-])OP([O-])(=O)OC1(C(C(C(C(O1)C)[N+])OC2(OC(COP(OCC(C(C(CO)O)O)O)(=O)[O-])C(O)C(O)C(O)2))NC(C)=O))C)C)C)C)C)C)C

InChI:

1S/C74H127N2O22P3/c1-50(2)25-15-26-51(3)27-16-28-52(4)29-17-30-53(5)31-18-32-54(6)33-19-34-55(7)35-20-36-56(8)37-21-38-57(9)39-22-40-58(10)41-23-42-59(11)43-24-44-60(12)45-46-91-100(87,88)98-101(89,90)97-73-67(76-62(14)78)72(66(75)61(13)94-73)96-74-71(84)70(83)69(82)65(95-74)49-93-99(85,86)92-48-64(80)68(81)63(79)47-77/h25,27,29,31,33,35,37,39,41,43,45,61,63-74,77,79-84H,15-24,26,28,30,32,34,36,38,40,42,44,46-49,75H2,1-14H3,(H,76,78)(H,85,86)(H,87,88)(H,89,90)/p-2/b51-27+,52-29+,53-31-,54-33-,55-35-,56-37-,57-39-,58-41-,59-43-,60-45-/t61-,63+,64-,65-,66+,67-,68+,69-,70+,71-,72+,73+,74+/m1/s1

InChIKey:

PLTGFWPQYWNYSK-GZZCEPAZSA-L

Synonyms

6-O-(phosphoribitol)-β-D-glucosyl-(1→3)-2-acetamido-4-amino-2,4,6-trideoxy-β-D-galactosyl-diphospho-ditrans,octacis-undecaprenol

Databases

MetaCyc: CPD-19323

PubChem (CID): 122706592

MetaNetX: MNXM165105