Glycoside
GD037474
Name:
NoneFormula:
C21H22O8N2Smiles:
OCC1OC(c2c(O)ccc(-c3n[nH]cc3-c3ccc(O)cc3)c2O)C(O)C(O)C1OAglycone:
Oc1ccc(-c2c[nH]nc2-c2ccc(O)cc2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.29 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 430.41 | Num_heavy_atoms: | 31 |
| TPSA: | 179.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD23598
Formula: C15H12O3N2
Smiles:
Oc1ccc(-c2c[nH]nc2-c2ccc(O)cc2O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.27 | Num_heavy_atoms: | 20 |
| TPSA: | 89.37 | NumAromaticRings: | 3 |
