Glycoside
GD158082
Name:
NoneFormula:
C19H27O12NSmiles:
Nc1ccc(C(=O)OCC2OC(OC3(CO)OC(CO)C(O)C3O)C(O)C(O)C2O)cc1Aglycone:
COC(=O)c1ccc(N)cc1Sugarmoiety:
OCC1OC(CO)(OC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.63 |
| AlogP: | -3.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 461.42 | Num_heavy_atoms: | 32 |
| TPSA: | 221.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD44990
Formula: C8H9O2N
Smiles:
COC(=O)c1ccc(N)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 151.17 | Num_heavy_atoms: | 11 |
| TPSA: | 52.32 | NumAromaticRings: | 1 |
