Glycoside
GD003680
Name:
NoneFormula:
C12H15O6N2ClSmiles:
O=c1[nH]c(=O)n(C2O[C@H](CO)[C@H](O)[C@H]2O)cc1CCClAglycone:
O=c1[nH]cc(CCCl)c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 306.7 | Num_heavy_atoms: | 20 |
| TPSA: | 124.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD03310
Formula: C7H7O2N2Cl
Smiles:
O=c1[nH]cc(CCCl)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 174.59 | Num_heavy_atoms: | 11 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
