GD148049
Name:
1-{10,14,16,19,20,24,26,28,34,35,36,37,42,44,47,51,57,61,63,66,67-henicosahydroxy-13,40,49,56,66-pentamethyl-2,30-dioxo-31,69-dioxa-3-azabicyclo[63.3.1]nonahexaconta-5,7,11,17,21,38,45,49,53,55,59-undecaen-32-yl}-4,5,8,11,12,14-hexahydroxy-6-methyl-17-{4-methyl-8-[2,3,6,7-tetrahydroxy-4-methyl-7-(4,5,6-trihydroxy-6-{[3,4,5-trihydroxy-7-(sulfooxy)tetradecanamido]methyl}oxan-2-yl)heptyl]-1,7-dioxaspiro[5.5]undecan-2-yl}heptadec-9-ene-3-sulfonic acid
Formula:
C127H218O52N2S2
Smiles:
CCCCCCCC(CC(O)C(O)C(O)CC(O)=NCC1(O)OC(C(O)C(O)CC(C)C(O)C(O)CC2CCCC3(CC(C)CC(CCCC(O)CC(O)C(O)C=CC(O)CC(C)C(O)C(O)C(CCC4CC(O)C(O)C(O)C(O)C=CC(C)CC(O)CC(O)C=CC(O)CC(C)=CC(O)CC=CC=C(C)C(O)CC=CC(O)CC(O)CC5OC(CC(O)C5(C)O)C(O)=NCC=CC=CCC(O)C=CC(C)C(O)CC(O)C=CC(O)C(O)C=CCC(O)CC(O)CC(O)CC(=O)O4)S(=O)(=O)O)O3)O2)CC(O)C1O)OS(=O)(=O)O
Aglycone:
CC1=CC(O)CC=CC=C(C)C(O)CC=CC(O)CC(O)CC2OC(CC(O)C2(C)O)C(O)=NCC=CC=CCC(O)C=CC(C)C(O)CC(O)C=CC(O)C(O)C=CCC(O)CC(O)CC(O)CC(=O)OC(CCC(C(O)C(O)C(C)CC(O)C=CC(O)C(O)CC(O)CCCC2CC(C)CC3(CCCC(CC(O)C(O)C(C)CC(O)CO)O3)O2)S(=O)(=O)O)CC(O)C(O)C(O)C(O)C=CC(C)CC(O)CC(O)C=CC(O)C1.CCCCCCCC(CC(O)C(O)C(O)CC(O)=NC)OS(=O)(=O)O
Sugarmoiety:
OC1CC(O)C(O)C(O)(O)O1
Other Identifiers
