Glycoside
GD086158
Name:
NoneFormula:
C25H27O5NSmiles:
CC1(C)c2cc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ccc2-c2c1ccc1ccccc21Aglycone:
CC1(C)c2cc(N)ccc2-c2c1ccc1ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 421.49 | Num_heavy_atoms: | 31 |
| TPSA: | 102.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD38265
Formula: C19H17N
Smiles:
CC1(C)c2cc(N)ccc2-c2c1ccc1ccccc21| HBA: | 1 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.16 |
| AlogP: | 4.73 | Num_rotatable_bonds: | 0 |
| MolWt: | 259.35 | Num_heavy_atoms: | 20 |
| TPSA: | 26.02 | NumAromaticRings: | 3 |
