Glycoside
GD015974
Name:
NoneFormula:
C17H19O5N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(=NOCc4ccccc4)[nH]cnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc[nH]c2=NOCc2ccccc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 373.37 | Num_heavy_atoms: | 27 |
| TPSA: | 138.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD11552
Formula: C12H10ON5
Smiles:
C1=Nc2c(nc[nH]c2=NOCc2ccccc2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 240.25 | Num_heavy_atoms: | 18 |
| TPSA: | 76.73 | NumAromaticRings: | 2 |
