Glycoside
GD115428
Name:
N-(5-{[3-acetamido-5-({4-[(3-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-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-dihydroxyoxan-2-yl}oxy)-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-3-yl)acetamideFormula:
C62H104O45N4Smiles:
CC(O)=NC1C(O)OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4N=C(C)O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4N=C(C)O)C3O)C(O)C2N=C(C)O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(O)OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4N=C(C)O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4N=C(C)O)C3O)C(O)C2N=C(C)O)C1OOther Identifiers
Properties
| HBA: | 49 | RingCount: | 9 |
| HBD: | 28 | FractionCSP3: | 0.94 |
| AlogP: | -15.66 | Num_rotatable_bonds: | 28 |
| MolWt: | 1625.5 | Num_heavy_atoms: | 111 |
| TPSA: | 772.79 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD04618
CC(O)=NC1C(O)OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(CO)C(O)C(O)C5O)C(O)C4N=C(C)O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4N=C(C)O)C3O)C(O)C2N=C(C)O)C1O