Glycoside
GD028111
Name:
NoneFormula:
C27H33O10NSmiles:
CCC(C)C(N=C1c2c(O)cccc2C([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21)C(=O)OAglycone:
CCC(C)C(N=C1c2c(O)cccc2Cc2cc(CO)cc(O)c21)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.48 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 531.56 | Num_heavy_atoms: | 38 |
| TPSA: | 200.5 | NumAromaticRings: | 2 |
Unique Aglycone
AD18405
Formula: C21H23O5N
Smiles:
CCC(C)C(N=C1c2c(O)cccc2Cc2cc(CO)cc(O)c21)C(=O)O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 369.42 | Num_heavy_atoms: | 27 |
| TPSA: | 110.35 | NumAromaticRings: | 2 |
