Glycoside
GD026385
Name:
NoneFormula:
C24H30O11N5PSSmiles:
COc1c(C)c2c(c(O)c1CCOP(=O)(O)CCSc1nc3c(N)ncnc3n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)C(=O)OC2Aglycone:
COc1c(C)c2c(c(O)c1CCOP(=O)(O)CCSC1=Nc3c(N)ncnc3[N]1)C(=O)OC2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 11 |
| MolWt: | 627.57 | Num_heavy_atoms: | 42 |
| TPSA: | 241.83 | NumAromaticRings: | 3 |
Unique Aglycone
AD17395
Formula: C19H21O7N5PS
Smiles:
COc1c(C)c2c(c(O)c1CCOP(=O)(O)CCSC1=Nc3c(N)ncnc3[N]1)C(=O)OC2| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 494.45 | Num_heavy_atoms: | 33 |
| TPSA: | 180.55 | NumAromaticRings: | 2 |
