Glycoside
GD006118
Name:
SACCHARUMOSIDE CFormula:
C19H26O13Smiles:
COC(=O)c1cc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)ccc1OAglycone:
COC(=O)c1cc(O)ccc1OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | -3.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 462.4 | Num_heavy_atoms: | 32 |
| TPSA: | 204.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD05089
Formula: C8H8O4
Smiles:
COC(=O)c1cc(O)ccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 1 |
| MolWt: | 168.15 | Num_heavy_atoms: | 12 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
