Glycoside
GD020227
Name:
NoneFormula:
C13H21O6N5Smiles:
C[C@]1(O)C(n2cnc3c2NCN=C3NOCCO)O[C@H](CO)[C@H]1OAglycone:
OCCONC1=NCNC2=C1N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -2.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 153.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD14001
Formula: C7H10O2N5
Smiles:
OCCONC1=NCNC2=C1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.19 | Num_heavy_atoms: | 14 |
| TPSA: | 92.34 | NumAromaticRings: | 0 |
