Glycoside
GD119537
Name:
Rumejaposide AFormula:
C22H22O11Smiles:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cccc1C2(O)C1OC(CO)C(O)C(O)C1OAglycone:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cccc1C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.36 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 462.41 | Num_heavy_atoms: | 33 |
| TPSA: | 205.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD47912
Formula: C16H12O6
Smiles:
Cc1cc2c(c(O)c1C(=O)O)C(=O)c1c(O)cccc1C2O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.12 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 1 |
| MolWt: | 300.27 | Num_heavy_atoms: | 22 |
| TPSA: | 115.06 | NumAromaticRings: | 2 |
