Glycoside
GD075169
Name:
NoneFormula:
C18H23O7N3Smiles:
Cc1ccn2c(=O)c(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)cnc2c1Aglycone:
Cc1ccn2c(=O)c(C(=O)NCCO)cnc2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.4 | Num_heavy_atoms: | 28 |
| TPSA: | 142.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD34814
Formula: C12H13O3N3
Smiles:
Cc1ccn2c(=O)c(C(=O)NCCO)cnc2c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 247.25 | Num_heavy_atoms: | 18 |
| TPSA: | 83.7 | NumAromaticRings: | 2 |
