Glycoside
GD124906
Name:
3-{[(2-hydroxyphenyl)methylidene]amino}-1-(3,4,5-trihydroxyoxan-2-yl)ureaFormula:
C13H17O6N3Smiles:
OC(=NC1OCC(O)C(O)C1O)NN=Cc1ccccc1OAglycone:
N=C(O)NN=Cc1ccccc1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.29 | Num_heavy_atoms: | 22 |
| TPSA: | 147.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD50495
Formula: C8H9O2N3
Smiles:
N=C(O)NN=Cc1ccccc1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 179.18 | Num_heavy_atoms: | 13 |
| TPSA: | 88.7 | NumAromaticRings: | 1 |
