Glycoside
GD011313
Name:
NoneFormula:
C35H58O10Smiles:
CC(C)(O)[C@@H]1CC[C@](C)([C@@H]2[C@H](O)[C@H](O)[C@]3(C)[C@@H]4[C@H](O)C[C@@H]5C(C)(C)[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)CC[C@]56C[C@@]46CC[C@]23C)O1Aglycone:
CC(C)(O)C1CCC(C)(C2C(O)C(O)C3(C)C4C(O)CC5C(C)(C)C(O)CCC56CC46CCC23C)O1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 4 |
| MolWt: | 638.84 | Num_heavy_atoms: | 45 |
| TPSA: | 169.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD08660
Formula: C30H50O6
Smiles:
CC(C)(O)C1CCC(C)(C2C(O)C(O)C3(C)C4C(O)CC5C(C)(C)C(O)CCC56CC46CCC23C)O1| HBA: | 6 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 2 |
| MolWt: | 506.72 | Num_heavy_atoms: | 36 |
| TPSA: | 110.38 | NumAromaticRings: | 0 |
