Glycoside
GD066825
Name:
NoneFormula:
C15H25O7N3Smiles:
OC[C@H]1O[C@@](CO)(OCCn2cc(C3CCOCC3)nn2)[C@@H](O)[C@@H]1OAglycone:
OCCn1cc(C2CCOCC2)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 359.38 | Num_heavy_atoms: | 25 |
| TPSA: | 139.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD31959
Formula: C9H15O2N3
Smiles:
OCCn1cc(C2CCOCC2)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 197.24 | Num_heavy_atoms: | 14 |
| TPSA: | 60.17 | NumAromaticRings: | 1 |
