Glycoside
GD040514
Name:
(1r,4s,5s,6r)-4-amino-5,6-dihydroxy-2-(hydroxymethyl)cyclohex-2-en-1-yl alpha-d-glucopyranosideFormula:
C13H23O9NSmiles:
N[C@H]1C=C(CO)[C@@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1OAglycone:
NC1C=C(CO)C(O)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.85 |
| AlogP: | -4.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 337.32 | Num_heavy_atoms: | 23 |
| TPSA: | 186.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD02201
Formula: C7H13O4N
Smiles:
NC1C=C(CO)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.18 | Num_heavy_atoms: | 12 |
| TPSA: | 106.94 | NumAromaticRings: | 0 |
