Glycoside
GD003066
Name:
NoneFormula:
C20H25O8NSmiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](Oc2ccc3c(=O)c(NC(C)=O)coc3c2C)OC1(C)CAglycone:
CC(=O)Nc1coc2c(C)c(O)ccc2c1=OSugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 407.42 | Num_heavy_atoms: | 29 |
| TPSA: | 127.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD02827
Formula: C12H11O4N
Smiles:
CC(=O)Nc1coc2c(C)c(O)ccc2c1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 233.22 | Num_heavy_atoms: | 17 |
| TPSA: | 79.54 | NumAromaticRings: | 2 |
