Glc-AATGal-PP-undecaprenol
Chemical Formula:
C69H115N2O15P2
Molecular Weight:
1274.619 Daltons
Monoisotopic Mass:
1275.7929191176001 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(CO)C(O)C(O)C(O)2))NC(C)=O))C)C)C)C)C)C)C
InChI:
1S/C69H116N2O15P2/c1-48(2)25-15-26-49(3)27-16-28-50(4)29-17-30-51(5)31-18-32-52(6)33-19-34-53(7)35-20-36-54(8)37-21-38-55(9)39-22-40-56(10)41-23-42-57(11)43-24-44-58(12)45-46-81-87(77,78)86-88(79,80)85-68-63(71-60(14)73)67(62(70)59(13)82-68)84-69-66(76)65(75)64(74)61(47-72)83-69/h25,27,29,31,33,35,37,39,41,43,45,59,61-69,72,74-76H,15-24,26,28,30,32,34,36,38,40,42,44,46-47,70H2,1-14H3,(H,71,73)(H,77,78)(H,79,80)/p-1/b49-27+,50-29+,51-31-,52-33-,53-35-,54-37-,55-39-,56-41-,57-43-,58-45-/t59-,61-,62+,63-,64-,65+,66-,67+,68+,69+/m1/s1
InChIKey:
Synonyms
- β-D-glucosyl-(1→3)-2-acetamido-4-amino-2,4,6-trideoxy-β-D-galactosyl-diphospho-ditrans,octacis-undecaprenol
Databases
MetaCyc:
CPD-19322
PubChem (CID):
122706150
MetaNetX:
MNXM164798