Glycoside
GD003079
Name:
SALVINICIN BFormula:
C26H38O11Smiles:
COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@]1(C)CC[C@@H]1C(=O)C[C@@H]([C@@]3(O)[C@H](O)[C@@H](OC)O[C@H]3OC)C[C@]12CAglycone:
COC(=O)C1CC(OC(C)=O)C(=O)C2C3(C)CCCC(=O)C3CCC12CSugarmoiety:
COC1OC(OC)C(O)(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 526.58 | Num_heavy_atoms: | 37 |
| TPSA: | 154.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD02839
Formula: C20H28O6
Smiles:
COC(=O)C1CC(OC(C)=O)C(=O)C2C3(C)CCCC(=O)C3CCC12C| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 364.44 | Num_heavy_atoms: | 26 |
| TPSA: | 86.74 | NumAromaticRings: | 0 |
