Glycoside
GD127637
Name:
Rumejaposide CFormula:
C22H22O12Smiles:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cc(O)cc1C2(O)C1OC(CO)C(O)C(O)C1OAglycone:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cc(O)cc1C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.36 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 478.41 | Num_heavy_atoms: | 34 |
| TPSA: | 225.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD51687
Formula: C16H12O7
Smiles:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cc(O)cc1C2O| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.12 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 316.26 | Num_heavy_atoms: | 23 |
| TPSA: | 135.29 | NumAromaticRings: | 2 |
