Glycoside
GD011365
Name:
NoneFormula:
C29H44O9Smiles:
CO[C@H]1[C@H](O)[C@@H](O[C@@H]2CC[C@@]3(O)[C@@H](CC[C@H]4[C@H]3CC[C@]3(C)[C@H](C5=CC(=O)OC5)CC[C@@]43O)C2)O[C@@H](C)[C@H]1OAglycone:
CC12CCC3C(CCC4CC(O)CCC43O)C1(O)CCC2C1=CC(=O)OC1Sugarmoiety:
COC1C(O)C(C)OC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 536.66 | Num_heavy_atoms: | 38 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD07694
Formula: C22H32O5
Smiles:
CC12CCC3C(CCC4CC(O)CCC43O)C1(O)CCC2C1=CC(=O)OC1| HBA: | 5 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 376.49 | Num_heavy_atoms: | 27 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
