Glycoside
GD016336
Name:
NoneFormula:
C25H31O8NSmiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](Oc2ccc(CCNC(C)=O)c(-c3ccc4c(c3)OCO4)c2)OC1(C)CAglycone:
CC(=O)NCCc1ccc(O)cc1-c1ccc2c(c1)OCO2Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.48 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 473.52 | Num_heavy_atoms: | 34 |
| TPSA: | 115.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD11781
Formula: C17H17O4N
Smiles:
CC(=O)NCCc1ccc(O)cc1-c1ccc2c(c1)OCO2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 299.33 | Num_heavy_atoms: | 22 |
| TPSA: | 67.79 | NumAromaticRings: | 2 |
