Glycoside
GD024922
Name:
NoneFormula:
C22H23O4N2Smiles:
Cc1c2cc[n+](C3O[C@H](CO)[C@H](O)[C@H]3O)cc2c(C)c2c1[nH]c1ccccc12Aglycone:
Cc1c2cc[nH+]cc2c(C)c2c1[nH]c1ccccc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 2 |
| MolWt: | 379.44 | Num_heavy_atoms: | 28 |
| TPSA: | 89.59 | NumAromaticRings: | 4 |
Unique Aglycone
AD03510
Formula: C17H15N2
Smiles:
Cc1c2cc[nH+]cc2c(C)c2c1[nH]c1ccccc12| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.91 | Num_rotatable_bonds: | 0 |
| MolWt: | 247.32 | Num_heavy_atoms: | 19 |
| TPSA: | 29.93 | NumAromaticRings: | 4 |
