Glycoside
GD071212
Name:
NoneFormula:
C16H20O7N4Smiles:
CC(=O)N[C@H]1[C@H](Oc2n[nH]c(=O)c3c(N)cccc23)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Nc1cccc2c(O)n[nH]c(=O)c12Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 380.36 | Num_heavy_atoms: | 27 |
| TPSA: | 180.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD33560
Formula: C8H7O2N3
Smiles:
Nc1cccc2c(O)n[nH]c(=O)c12| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 177.16 | Num_heavy_atoms: | 13 |
| TPSA: | 92.0 | NumAromaticRings: | 2 |
