Glycoside
GD028656
Name:
NoneFormula:
C24H31O7NSmiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](Oc2ccc(CCNC(C)=O)c(-c3ccc(O)cc3)c2)OC1(C)CAglycone:
CC(=O)NCCc1ccc(O)cc1-c1ccc(O)cc1Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 445.51 | Num_heavy_atoms: | 32 |
| TPSA: | 117.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD18699
Formula: C16H17O3N
Smiles:
CC(=O)NCCc1ccc(O)cc1-c1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 271.32 | Num_heavy_atoms: | 20 |
| TPSA: | 69.56 | NumAromaticRings: | 2 |
