Glycoside
GD004752
Name:
NoneFormula:
C10H12O6N4Smiles:
O=c1[nH]c(=O)c2[nH]nc([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2[nH]1Aglycone:
O=c1[nH]c(=O)c2[nH]ncc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.91 | Num_rotatable_bonds: | 2 |
| MolWt: | 284.23 | Num_heavy_atoms: | 20 |
| TPSA: | 164.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD04109
Formula: C5H4O2N4
Smiles:
O=c1[nH]c(=O)c2[nH]ncc2[nH]1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.11 | Num_heavy_atoms: | 11 |
| TPSA: | 94.4 | NumAromaticRings: | 2 |
