Glycoside
GD047706
Name:
NoneFormula:
C13H20O5N4Smiles:
C/C=C(\C)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC=C(C)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 312.33 | Num_heavy_atoms: | 22 |
| TPSA: | 142.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD25620
Formula: C8H11ON4
Smiles:
CC=C(C)NC1=C(C(N)=O)N=C[N]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 179.2 | Num_heavy_atoms: | 13 |
| TPSA: | 81.58 | NumAromaticRings: | 0 |
