Rib-ol-P-Gro-P-Gro-P-ManNAc-GlcNAc-PP-undecaprenol

Chemical Formula:

C₈₂H₁₃₈N₂O₃₄P₅

Molecular Weight:

1850.854 Daltons

Monoisotopic Mass:

1854.8210323021 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)CO)OC2(OC(CO)C(OP([O-])(=O)OCC(COP([O-])(=O)OCC(COP([O-])(=O)OCC(O)C(O)C(O)CO)O)O)C(O)C(NC(=O)C)2))O)NC(C)=O))C)C)C)C)C)C)C

InChI:

1S/C82H143N2O34P5/c1-55(2)25-15-26-56(3)27-16-28-57(4)29-17-30-58(5)31-18-32-59(6)33-19-34-60(7)35-20-36-61(8)37-21-38-62(9)39-22-40-63(10)41-23-42-64(11)43-24-44-65(12)45-46-107-122(103,104)118-123(105,106)117-82-75(84-67(14)89)77(95)79(72(48-86)114-82)115-81-74(83-66(13)88)78(96)80(73(49-87)113-81)116-121(101,102)111-53-69(91)52-109-119(97,98)108-50-68(90)51-110-120(99,100)112-54-71(93)76(94)70(92)47-85/h25,27,29,31,33,35,37,39,41,43,45,68-82,85-87,90-96H,15-24,26,28,30,32,34,36,38,40,42,44,46-54H2,1-14H3,(H,83,88)(H,84,89)(H,97,98)(H,99,100)(H,101,102)(H,103,104)(H,105,106)/p-5/b56-27+,57-29+,58-31-,59-33-,60-35-,61-37-,62-39-,63-41-,64-43-,65-45-/t68-,69+,70-,71+,72+,73+,74-,75+,76-,77+,78+,79?,80+,81-,82+/m0/s1

InChIKey:

WAOFXEGPSUNZBC-ZKVXEVJHSA-I

Synonyms

4-O-(D-ribitylphospho)-di[(2R)-1-glycerophospho]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol

Databases

MetaCyc: CPD-19302

PubChem (CID): 126961111

MetaNetX: MNXM165106