Glycoside
GD019381
Name:
NoneFormula:
C29H40O10Smiles:
C[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C=O)[C@H]4[C@H](C=C[C@@]3(O)C2)[C@]2(O)CC[C@@H](C3=CC(=O)OC3)[C@@]2(C)C[C@H]4O)C[C@H](O)[C@H]1OAglycone:
CC12CC(O)C3C(C=CC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1Sugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 548.63 | Num_heavy_atoms: | 39 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD13536
Formula: C23H30O7
Smiles:
CC12CC(O)C3C(C=CC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.74 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 418.49 | Num_heavy_atoms: | 30 |
| TPSA: | 124.29 | NumAromaticRings: | 0 |
