Glycoside
GD004222
Name:
NoneFormula:
C31H46O10Smiles:
COC(=O)[C@@H]1[C@H](C(=O)CC[C@@H]2[C@H](C)OC(=O)[C@H]2C)CC=C2C[C@H](O[C@@H]3C[C@H](OC)[C@H](OC(C)=O)[C@H](C)O3)CC[C@]21CAglycone:
COC(=O)C1C(C(=O)CCC2C(C)OC(=O)C2C)CC=C2CC(O)CCC21CSugarmoiety:
COC1CC(O)OC(C)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.81 |
| AlogP: | 3.93 | Num_rotatable_bonds: | 9 |
| MolWt: | 578.7 | Num_heavy_atoms: | 41 |
| TPSA: | 123.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD03715
Formula: C22H32O6
Smiles:
COC(=O)C1C(C(=O)CCC2C(C)OC(=O)C2C)CC=C2CC(O)CCC21C| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.77 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 392.49 | Num_heavy_atoms: | 28 |
| TPSA: | 89.9 | NumAromaticRings: | 0 |
