Glycoside
GD026070
Name:
NoneFormula:
C24H29O11N6PSmiles:
COc1c(C)c2c(c(O)c1CCOP(=O)(O)CC(=O)NC[C@@H]1O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]1O)C(=O)OC2Aglycone:
CNC(=O)CP(=O)(O)OCCc1c(O)c2c(c(C)c1OC)COC2=O.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 10 |
| MolWt: | 608.5 | Num_heavy_atoms: | 42 |
| TPSA: | 250.7 | NumAromaticRings: | 3 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD17211
Formula: C15H20O8NP
Smiles:
CNC(=O)CP(=O)(O)OCCc1c(O)c2c(c(C)c1OC)COC2=O| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 373.3 | Num_heavy_atoms: | 25 |
| TPSA: | 131.39 | NumAromaticRings: | 1 |
