Glycoside
GD033624
Name:
NoneFormula:
C30H42O10Smiles:
C[C@@]12CC[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)C=C1CC[C@@H]1[C@H]2[C@H](O)C[C@]2(C)[C@H](c3ccc(=O)oc3)CC[C@]12OAglycone:
CC12CCC(O)C=C1CCC1C2C(O)CC2(C)C(c3ccc(=O)oc3)CCC12OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.77 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 4 |
| MolWt: | 562.66 | Num_heavy_atoms: | 40 |
| TPSA: | 170.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD20269
Formula: C24H32O5
Smiles:
CC12CCC(O)C=C1CCC1C2C(O)CC2(C)C(c3ccc(=O)oc3)CCC12O| HBA: | 5 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 3.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 400.52 | Num_heavy_atoms: | 29 |
| TPSA: | 90.9 | NumAromaticRings: | 1 |
