Glycoside
GD154027
Name:
N-{5-[(6-{[(3-{[3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]methyl}-3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamideFormula:
C40H68O31N2Smiles:
CC(O)=NC1C(O)OC(CO)C(OC2OC(COC3OC(CO)C(O)C(O)C3OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3N=C(C)O)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(O)OC(CO)C(OC2OC(COC3OC(CO)C(O)C(O)C3OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3N=C(C)O)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C1OOther Identifiers
Properties
| HBA: | 33 | RingCount: | 6 |
| HBD: | 20 | FractionCSP3: | 0.95 |
| AlogP: | -12.13 | Num_rotatable_bonds: | 18 |
| MolWt: | 1072.97 | Num_heavy_atoms: | 73 |
| TPSA: | 530.85 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD10197
CC(O)=NC1C(O)OC(CO)C(OC2OC(COC3OC(CO)C(O)C(O)C3OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3N=C(C)O)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C1O