Glycoside
GD011030
Name:
NoneFormula:
C33H54O9Smiles:
C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@@H]3[C@@H]4CC[C@@H]5[C@H](O)[C@H](O)C[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@@]5(C)[C@H]4CC[C@@]3(C)[C@@H]1[C@H]2CAglycone:
CC1CCC2(OC1)OC1CC3C4CCC5C(O)C(O)CC(O)C5(C)C4CCC3(C)C1C2CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 594.79 | Num_heavy_atoms: | 42 |
| TPSA: | 138.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD08459
Formula: C27H44O5
Smiles:
CC1CCC2(OC1)OC1CC3C4CCC5C(O)C(O)CC(O)C5(C)C4CCC3(C)C1C2C| HBA: | 5 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 3.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 448.64 | Num_heavy_atoms: | 32 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
