Glycoside
GD053968
Name:
NoneFormula:
C15H22O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)Cc2ccccn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(Cc1ccccn1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 326.35 | Num_heavy_atoms: | 23 |
| TPSA: | 121.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD27499
Formula: C9H12O2N2
Smiles:
O=C(Cc1ccccn1)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 180.21 | Num_heavy_atoms: | 13 |
| TPSA: | 62.22 | NumAromaticRings: | 1 |
