Glycoside
GD012729
Name:
NoneFormula:
C16H21O9NSmiles:
O=C(O)c1cc(NCCC2OC(CO)C(O)C(O)C2O)cc(C(=O)O)c1Aglycone:
CCNc1cc(C(=O)O)cc(C(=O)O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 371.34 | Num_heavy_atoms: | 26 |
| TPSA: | 176.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD09564
Formula: C10H11O4N
Smiles:
CCNc1cc(C(=O)O)cc(C(=O)O)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 209.2 | Num_heavy_atoms: | 15 |
| TPSA: | 86.63 | NumAromaticRings: | 1 |
