Glycoside
GD115708
Name:
CedrinosideFormula:
C22H24O13Smiles:
Cc1c(O)cc2c(c1O)C(=O)C(O)C(c1cc(O)c(O)c(OC3OC(CO)C(O)C(O)C3O)c1)O2Aglycone:
Cc1c(O)cc2c(c1O)C(=O)C(O)C(c1cc(O)c(O)c(O)c1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.41 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 496.42 | Num_heavy_atoms: | 35 |
| TPSA: | 226.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD45826
Formula: C16H14O8
Smiles:
Cc1c(O)cc2c(c1O)C(=O)C(O)C(c1cc(O)c(O)c(O)c1)O2| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.19 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 334.28 | Num_heavy_atoms: | 24 |
| TPSA: | 147.68 | NumAromaticRings: | 2 |
