Glycoside
GD004455
Name:
NoneFormula:
C31H53O10NSmiles:
CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@H](CCO)C[C@H](C)C(=O)C=CC(C)=C[C@H]1COAglycone:
CCC1OC(=O)CC(O)C(C)C(O)C(CCO)CC(C)C(=O)C=CC(C)=CC1COSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 599.76 | Num_heavy_atoms: | 42 |
| TPSA: | 166.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD00857
Formula: C23H38O7
Smiles:
CCC1OC(=O)CC(O)C(C)C(O)C(CCO)CC(C)C(=O)C=CC(C)=CC1CO| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.74 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 426.55 | Num_heavy_atoms: | 30 |
| TPSA: | 124.29 | NumAromaticRings: | 0 |
