Glycoside
GD029691
Name:
NoneFormula:
C18H22O6N4Smiles:
Nc1ccn([C@@H]2O[C@H](C(=O)N[C@H](CO)Cc3ccccc3)[C@H](O)[C@H]2O)c(=O)n1Aglycone:
Nc1cc[nH]c(=O)n1.O=CNC(CO)Cc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 390.4 | Num_heavy_atoms: | 28 |
| TPSA: | 159.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD07420
Formula: C10H13O2N
Smiles:
O=CNC(CO)Cc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 179.22 | Num_heavy_atoms: | 13 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
