Glycoside
GD032910
Name:
NoneFormula:
C18H19O4N4ISmiles:
COc1ccc(Nc2ncnc3c2c(I)cn3[C@@H]2O[C@H](C)[C@H](O)[C@H]2O)cc1Aglycone:
COc1ccc(Nc2ncnc3c2C(I)=C[N]3)cc1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 482.28 | Num_heavy_atoms: | 27 |
| TPSA: | 101.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD21048
Formula: C13H10ON4I
Smiles:
COc1ccc(Nc2ncnc3c2C(I)=C[N]3)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.15 | Num_heavy_atoms: | 19 |
| TPSA: | 61.14 | NumAromaticRings: | 2 |
