Glycoside
GD054006
Name:
NoneFormula:
C15H22O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccnc(CO)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccnc(CO)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 342.35 | Num_heavy_atoms: | 24 |
| TPSA: | 141.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD27525
Formula: C9H12O3N2
Smiles:
O=C(NCCO)c1ccnc(CO)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 196.21 | Num_heavy_atoms: | 14 |
| TPSA: | 82.45 | NumAromaticRings: | 1 |
