Glycoside
GD014381
Name:
NoneFormula:
C29H44O9Smiles:
C[C@@]12CC[C@H](OC[C@@H]3O[C@H](O)[C@H](O)[C@H](O)[C@H]3O)CC1CC[C@@H]1[C@H]2CC[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12OAglycone:
COC1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 536.66 | Num_heavy_atoms: | 38 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD05019
Formula: C24H36O4
Smiles:
COC1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1| HBA: | 4 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 4.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 388.55 | Num_heavy_atoms: | 28 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
