Glycoside
GD081490
Name:
NoneFormula:
C20H29O7N3Smiles:
CC(C)c1nccc([C@@H]2C[C@@H]3CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C[C@H]3O2)n1Aglycone:
CC(C)c1nccc(C2CC3CCNCC3O2)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 423.47 | Num_heavy_atoms: | 30 |
| TPSA: | 153.31 | NumAromaticRings: | 1 |
Unique Aglycone
AD36687
Formula: C14H21ON3
Smiles:
CC(C)c1nccc(C2CC3CCNCC3O2)n1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.71 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 2 |
| MolWt: | 247.34 | Num_heavy_atoms: | 18 |
| TPSA: | 47.04 | NumAromaticRings: | 1 |
