Glycoside
GD030656
Name:
NoneFormula:
C19H21O6N7Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NC(=O)Nc4ccc(OC)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
COc1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 443.42 | Num_heavy_atoms: | 32 |
| TPSA: | 172.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD18096
Formula: C13H11O2N6
Smiles:
COc1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 283.27 | Num_heavy_atoms: | 21 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
