Glycoside
GD015396
Name:
Pneumatopterin AFormula:
C29H38O15Smiles:
Cc1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(CO)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c2c1O[C@H](c1ccccc1)C[C@H]2OAglycone:
Cc1c(O)c(CO)c(O)c2c1OC(c1ccccc1)CC2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.59 |
| AlogP: | -2.6 | Num_rotatable_bonds: | 8 |
| MolWt: | 626.61 | Num_heavy_atoms: | 44 |
| TPSA: | 248.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD11193
Formula: C17H18O5
Smiles:
Cc1c(O)c(CO)c(O)c2c1OC(c1ccccc1)CC2O| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 302.33 | Num_heavy_atoms: | 22 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
