Glycoside
GD075149
Name:
NoneFormula:
C16H17O6N5Smiles:
O=C(Nc1ncnc2c1[nH]c(=O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1=CC=CC1Aglycone:
O=C(Nc1ncnc2[nH]c(=O)[nH]c12)C1=CC=CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 375.34 | Num_heavy_atoms: | 27 |
| TPSA: | 162.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD34803
Formula: C11H9O2N5
Smiles:
O=C(Nc1ncnc2[nH]c(=O)[nH]c12)C1=CC=CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.09 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 243.23 | Num_heavy_atoms: | 18 |
| TPSA: | 103.53 | NumAromaticRings: | 2 |
