Glycoside
GD020862
Name:
AltosideFormula:
C30H40O10Smiles:
C[C@@]12CC[C@@H]3[C@H](CCC4=C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@]43C=O)[C@@]1(O)CC[C@H]2c1ccc(=O)oc1Aglycone:
CC12CCC3C(CCC4=CC(O)CCC43C=O)C1(O)CCC2c1ccc(=O)oc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 560.64 | Num_heavy_atoms: | 40 |
| TPSA: | 166.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD14335
Formula: C24H30O5
Smiles:
CC12CCC3C(CCC4=CC(O)CCC43C=O)C1(O)CCC2c1ccc(=O)oc1| HBA: | 5 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 3.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 398.5 | Num_heavy_atoms: | 29 |
| TPSA: | 87.74 | NumAromaticRings: | 1 |
