Glycoside
GD053785
Name:
NoneFormula:
C14H20O6N3Smiles:
COc1cc2[nH+]ccn2cc1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COc1cc2[nH+]ccn2cc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.33 | Num_heavy_atoms: | 23 |
| TPSA: | 129.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD27418
Formula: C8H10ON3
Smiles:
COc1cc2[nH+]ccn2cc1N| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.19 | Num_heavy_atoms: | 12 |
| TPSA: | 53.8 | NumAromaticRings: | 2 |
