Glycoside
GD115373
Name:
1-{[(3,4-dimethoxyphenyl)methylidene]amino}-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ureaFormula:
C16H23O8N3Smiles:
COc1ccc(C=NNC(O)=NC2OC(CO)C(O)C(O)C2O)cc1OCAglycone:
COc1ccc(C=NNC(=N)O)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 385.37 | Num_heavy_atoms: | 27 |
| TPSA: | 165.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD45628
Formula: C10H13O3N3
Smiles:
COc1ccc(C=NNC(=N)O)cc1OC| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.23 | Num_heavy_atoms: | 16 |
| TPSA: | 86.93 | NumAromaticRings: | 1 |
