N4-{N-acetyl-β-D-glucosaminyl-(1,2)-α-D-mannosyl-(1,3)-[N-acetyl-β-D-glucosaminyl-(1,2)-α-D-mannosyl-(1,6)]-β-D-mannosyl-(1,4)-N-acetyl-β-D-glucosaminyl-(1,4)-N-acetyl-β-D-glucosaminyl}asparagine





Chemical Formula:
C54H90N6O38
Molecular Weight:
1431.322 Daltons
Monoisotopic Mass:
1430.5294525600002 Daltons
SMILES:
C(C(CC(NC7(OC(CO)C(OC6(OC(CO)C(OC5(OC(COC1(OC(CO)C(O)C(O)C1OC2(OC(CO)C(O)C(O)C(NC(C)=O)2)))C(O)C(OC4(OC(CO)C(O)C(O)C(OC3(OC(CO)C(O)C(O)C(NC(C)=O)3))4))C(O)5))C(O)C(NC(C)=O)6))C(O)C(NC(C)=O)7))=O)[N+])([O-])=O
InChI:
1S/C54H90N6O38/c1-13(67)56-26-37(79)42(22(10-65)87-47(26)60-25(71)5-17(55)48(84)85)94-51-29(59-16(4)70)38(80)43(23(11-66)92-51)95-52-41(83)44(96-54-46(40(82)33(75)21(9-64)91-54)98-50-28(58-15(3)69)36(78)31(73)19(7-62)89-50)34(76)24(93-52)12-86-53-45(39(81)32(74)20(8-63)90-53)97-49-27(57-14(2)68)35(77)30(72)18(6-61)88-49/h17-24,26-47,49-54,61-66,72-83H,5-12,55H2,1-4H3,(H,56,67)(H,57,68)(H,58,69)(H,59,70)(H,60,71)(H,84,85)/t17?,18-,19-,20-,21-,22-,23-,24-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39+,40+,41+,42-,43-,44+,45+,46+,47-,49+,50+,51+,52+,53+,54-/m1/s1

Synonyms
  • GnGn-glycopeptide
  • GnGn-GP

Databases
MetaCyc:  N4-N-ACETYL-BETA-D-GLUCOSAMINYL-12
PubChem (CID):  25200901