α-L-colitosyl-[1→2]-β-D-galactosyl-[1→3]-N-acetyl-β-D-glucosaminyl-[1→3]-α-D-galactosyl-[1→3]-N-acetyl-D-galactosamine
Chemical Formula:
C34H58N2O24
Molecular Weight:
878.831 Daltons
Monoisotopic Mass:
878.3379508026001 Daltons
SMILES:
CC5(OC(OC4(C(C(C(OC(OC3(C(C(OC(OC2(C(C(OC(OC1(C(C(OC(C1NC(=O)C)O)CO)O))C2O)CO)O))C3NC(=O)C)CO)O))4)CO)O)O))C(CC5O)O)
InChI:
1S/C34H58N2O24/c1-9-12(43)4-13(44)31(52-9)60-29-24(49)20(45)14(5-37)56-34(29)58-27-19(36-11(3)42)32(54-16(7-39)22(27)47)59-28-23(48)17(8-40)55-33(25(28)50)57-26-18(35-10(2)41)30(51)53-15(6-38)21(26)46/h9,12-34,37-40,43-51H,4-8H2,1-3H3,(H,35,41)(H,36,42)/t9-,12-,13-,14+,15+,16+,17+,18+,19+,20-,21-,22+,23-,24-,25+,26+,27+,28-,29+,30?,31-,32-,33+,34-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-18918
PubChem (CID):
122706351
MetaNetX:
MNXM166964