Glycoside
GD028645
Name:
NoneFormula:
C47H75O18NSmiles:
C[C@@H]1OC(=O)C[C@H](O)C[C@H](O)C[C@H](O)CC[C@H](O)[C@H](O)CC(=O)C[C@H](O)[C@H](C(=O)O)[C@H](O)C[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N)[C@H]2O)C=CC=CC=CC=CCCC=CC=C[C@@](C)(O)[C@H](O)[C@H]1CAglycone:
CC1OC(=O)CC(O)CC(O)CC(O)CCC(O)C(O)CC(=O)CC(O)C(C(=O)O)C(O)CC(O)C=CC=CC=CC=CCCC=CC=CC(C)(O)C(O)C1CSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.68 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 942.11 | Num_heavy_atoms: | 66 |
| TPSA: | 347.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD18693
Formula: C41H64O15
Smiles:
CC1OC(=O)CC(O)CC(O)CC(O)CCC(O)C(O)CC(=O)CC(O)C(C(=O)O)C(O)CC(O)C=CC=CC=CC=CCCC=CC=CC(C)(O)C(O)C1C| HBA: | 15 | RingCount: | 1 |
| HBD: | 11 | FractionCSP3: | 0.63 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 796.95 | Num_heavy_atoms: | 56 |
| TPSA: | 282.97 | NumAromaticRings: | 0 |
