Glycoside
GD133750
Name:
N-(4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-2-({1,4,5,6-tetrahydroxy-2-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]hexan-3-yl}oxy)oxan-3-yl)acetamideFormula:
C28H50O20N2Smiles:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(CO)OC3OC(C)C(O)C(O)C3O)C(O)C(O)CO)C2N=C(C)O)OC(CO)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(CO)OC3OC(C)C(O)C(O)C3O)C(O)C(O)CO)C2N=C(C)O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 0.93 |
| AlogP: | -7.12 | Num_rotatable_bonds: | 15 |
| MolWt: | 734.7 | Num_heavy_atoms: | 50 |
| TPSA: | 363.32 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD07699
CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(CO)OC3OC(C)C(O)C(O)C3O)C(O)C(O)CO)C2N=C(C)O)OC(CO)C(O)C1O