Glycoside
GD066972
Name:
NoneFormula:
C15H27O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])Cc2cncn2C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1cncc1CC([NH3+])C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.73 |
| AlogP: | -3.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 359.4 | Num_heavy_atoms: | 25 |
| TPSA: | 153.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD32017
Formula: C9H17O2N4
Smiles:
Cn1cncc1CC([NH3+])C(=O)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -2.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 213.26 | Num_heavy_atoms: | 15 |
| TPSA: | 94.79 | NumAromaticRings: | 1 |
