Glycoside
GD075096
Name:
NoneFormula:
C17H25O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cnc(=O)n(C3CCC3)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cnc(=O)n(C2CCC2)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 383.4 | Num_heavy_atoms: | 27 |
| TPSA: | 143.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD34766
Formula: C11H15O3N3
Smiles:
O=C(NCCO)c1cnc(=O)n(C2CCC2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.55 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 237.26 | Num_heavy_atoms: | 17 |
| TPSA: | 84.22 | NumAromaticRings: | 1 |
