Glycoside
GD139845
Name:
2-hydroxy-3-(3,4,5-trihydroxyoxan-2-yl)propanoic acidFormula:
C8H14O7Smiles:
O=C(O)C(O)CC1OCC(O)C(O)C1OAglycone:
CC(O)C(=O)OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 222.19 | Num_heavy_atoms: | 15 |
| TPSA: | 127.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD00056
Formula: C3H6O3
Smiles:
CC(O)C(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 1 |
| MolWt: | 90.08 | Num_heavy_atoms: | 6 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
