Glycoside
GD038468
Name:
4,6-dideoxy-4-{[(1s,4s,5s,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-beta-d-glucopyranoseFormula:
C13H23O8NSmiles:
CC1O[C@H](O)[C@H](O)[C@H](O)[C@@H]1N[C@@H]1C=C(CO)C(O)[C@@H](O)[C@H]1OAglycone:
NC1C=C(CO)C(O)C(O)C1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.85 |
| AlogP: | -4.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.33 | Num_heavy_atoms: | 22 |
| TPSA: | 162.87 | 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 |
