Glycoside
GD037706
Name:
n-(2-morpholin-4-yl-1-morpholin-4-ylmethyl-ethyl)-3-nitro-5-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-benzamideFormula:
C24H36O11N4Smiles:
O=C(NC(CN1CCOCC1)CN1CCOCC1)c1cc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc([N+](=O)[O-])c1Aglycone:
O=C(NC(CN1CCOCC1)CN1CCOCC1)c1cc(O)cc([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -2.46 | Num_rotatable_bonds: | 10 |
| MolWt: | 556.57 | Num_heavy_atoms: | 39 |
| TPSA: | 196.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD23706
Formula: C18H26O6N4
Smiles:
O=C(NC(CN1CCOCC1)CN1CCOCC1)c1cc(O)cc([N+](=O)[O-])c1| HBA: | 10 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.61 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 7 |
| MolWt: | 394.43 | Num_heavy_atoms: | 28 |
| TPSA: | 117.41 | NumAromaticRings: | 1 |
