Glycoside
GD058451
Name:
NoneFormula:
C14H18O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cnc(C#N)cn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
N#Cc1cnc(C(=O)NCCO)cn1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -2.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.32 | Num_heavy_atoms: | 24 |
| TPSA: | 157.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD29216
Formula: C8H8O2N4
Smiles:
N#Cc1cnc(C(=O)NCCO)cn1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.18 | Num_heavy_atoms: | 14 |
| TPSA: | 98.9 | NumAromaticRings: | 1 |
