Rib-ol-P-Gro-P-ManNAc-GlcNAc-PP-undecaprenol
Chemical Formula:
C79H132N2O29P4
Molecular Weight:
1697.803 Daltons
Monoisotopic Mass:
1700.8179224569 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(O)C(O)C(O)CO)O)C(O)C(NC(=O)C)2))O)NC(C)=O))C)C)C)C)C)C)C
InChI:
1S/C79H136N2O29P4/c1-53(2)25-15-26-54(3)27-16-28-55(4)29-17-30-56(5)31-18-32-57(6)33-19-34-58(7)35-20-36-59(8)37-21-38-60(9)39-22-40-61(10)41-23-42-62(11)43-24-44-63(12)45-46-101-113(97,98)110-114(99,100)109-79-72(81-65(14)86)74(91)76(69(48-83)106-79)107-78-71(80-64(13)85)75(92)77(70(49-84)105-78)108-112(95,96)103-51-66(87)50-102-111(93,94)104-52-68(89)73(90)67(88)47-82/h25,27,29,31,33,35,37,39,41,43,45,66-79,82-84,87-92H,15-24,26,28,30,32,34,36,38,40,42,44,46-52H2,1-14H3,(H,80,85)(H,81,86)(H,93,94)(H,95,96)(H,97,98)(H,99,100)/p-4/b54-27+,55-29+,56-31-,57-33-,58-35-,59-37-,60-39-,61-41-,62-43-,63-45-/t66-,67+,68-,69-,70-,71+,72-,73+,74-,75-,76?,77-,78+,79-/m1/s1
InChIKey:
Synonyms
- 4-O-[1-D-ribitylphospho-(2R)-1-glycerophospho]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol
Databases
MetaCyc:
CPD-19307
PubChem (CID):
126961003
MetaNetX:
MNXM165107