Glycoside
GD126505
Name:
2-[(3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]amino}phenyl)amino]-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C16H24O8N2Smiles:
OCC1OC(Nc2cccc(NC3OC(CO)C(O)C3O)c2)C(O)C1OAglycone:
Nc1cccc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.62 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 372.37 | Num_heavy_atoms: | 26 |
| TPSA: | 163.9 | NumAromaticRings: | 1 |
Unique Aglycone
AD51193
Formula: C6H8N2
Smiles:
Nc1cccc(N)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 0 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 52.04 | NumAromaticRings: | 1 |
