Glycoside
GD151681
Name:
3,4,5-trihydroxy-6-[(3-hydroxybutan-2-yl)oxy]oxane-2-carboxylic acidFormula:
C10H18O8Smiles:
CC(O)C(C)OC1OC(C(=O)O)C(O)C(O)C1OAglycone:
CC(O)C(C)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | -2.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.25 | Num_heavy_atoms: | 18 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD11750
Formula: C4H10O2
Smiles:
CC(O)C(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 90.12 | Num_heavy_atoms: | 6 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
