Glycoside
GD125939
Name:
N-(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-5-yl)acetamideFormula:
C20H33O14NSmiles:
CC(O)=NC1=COC(CO)C(OC2OC(CO)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C1OAglycone:
CC(O)=NC1=COC(CO)C(O)C1OSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.85 |
| AlogP: | -4.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 511.48 | Num_heavy_atoms: | 35 |
| TPSA: | 240.58 | NumAromaticRings: | 0 |
Unique Aglycone
AD50937
Formula: C8H13O5N
Smiles:
CC(O)=NC1=COC(CO)C(O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.19 | Num_heavy_atoms: | 14 |
| TPSA: | 102.51 | NumAromaticRings: | 0 |
