Glycoside
GD017184
Name:
NoneFormula:
C26H44O12Smiles:
CC1(C)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H]2[C@@](C)(O)[C@@H]3CC[C@@H]4[C@H](O)[C@@]3(C[C@H](O)[C@]21O)C[C@]4(C)OAglycone:
CC1(O)CC23CC(O)C4(O)C(C(O)C(O)C4(C)C)C(C)(O)C2CCC1C3OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | -3.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 548.63 | Num_heavy_atoms: | 38 |
| TPSA: | 220.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD12296
Formula: C20H34O7
Smiles:
CC1(O)CC23CC(O)C4(O)C(C(O)C(O)C4(C)C)C(C)(O)C2CCC1C3O| HBA: | 7 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 0 |
| MolWt: | 386.49 | Num_heavy_atoms: | 27 |
| TPSA: | 141.61 | NumAromaticRings: | 0 |
