Glycoside
GD106922
Name:
NoneFormula:
C30H42O11Smiles:
CO[C@H]1[C@@H](O)[C@H](C)O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](C2)C[C@H]2O[C@@]24[C@H]3[C@@H](O)C(=O)[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]42O)[C@@H]1OAglycone:
CC12CCC(O)CC1CC1OC13C2C(O)C(=O)C1(C)C(C2=CC(=O)OC2)CCC13OSugarmoiety:
COC1C(O)C(C)OC(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 7 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 578.66 | Num_heavy_atoms: | 41 |
| TPSA: | 164.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD44243
Formula: C23H30O7
Smiles:
CC12CCC(O)CC1CC1OC13C2C(O)C(=O)C1(C)C(C2=CC(=O)OC2)CCC13O| HBA: | 7 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 418.49 | Num_heavy_atoms: | 30 |
| TPSA: | 116.59 | NumAromaticRings: | 0 |
