Glycoside
GD033174
Name:
NoneFormula:
C14H17O5N7Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1c2ncnc(N)c2c2c(=O)[nH]c(N)nc21Aglycone:
Nc1nc2c(c(=O)[nH]1)-c1c(N)ncnc1[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.43 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 363.33 | Num_heavy_atoms: | 26 |
| TPSA: | 198.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD18069
Formula: C8H6ON7
Smiles:
Nc1nc2c(c(=O)[nH]1)-c1c(N)ncnc1[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 0 |
| MolWt: | 216.18 | Num_heavy_atoms: | 16 |
| TPSA: | 137.67 | NumAromaticRings: | 2 |
