Glycoside
GD106701
Name:
NoneFormula:
C19H22O6N7BrSmiles:
CCOc1ccc(Br)cc1/C=N/Nc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOc1ccc(Br)cc1C=NNC1=Nc2c(nc(N)[nH]c2=O)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.37 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 524.33 | Num_heavy_atoms: | 33 |
| TPSA: | 193.13 | NumAromaticRings: | 3 |
Unique Aglycone
AD44203
Formula: C14H13O2N7Br
Smiles:
CCOc1ccc(Br)cc1C=NNC1=Nc2c(nc(N)[nH]c2=O)[N]1| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.14 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 391.21 | Num_heavy_atoms: | 24 |
| TPSA: | 131.85 | NumAromaticRings: | 2 |
