Glycoside
GD075166
Name:
NoneFormula:
C18H23O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc3c(=O)n(C)cnc3c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1cnc2cc(C(=O)NCCO)ccc2c1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.4 | Num_heavy_atoms: | 28 |
| TPSA: | 143.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD34813
Formula: C12H13O3N3
Smiles:
Cn1cnc2cc(C(=O)NCCO)ccc2c1=O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 247.25 | Num_heavy_atoms: | 18 |
| TPSA: | 84.22 | NumAromaticRings: | 2 |
