Glycoside
GD067535
Name:
NoneFormula:
C15H21O7N3Smiles:
COC(OC)c1c(C#N)ccnc1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COC(OC)c1c(C#N)ccnc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 157.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD32183
Formula: C9H11O2N3
Smiles:
COC(OC)c1c(C#N)ccnc1N| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 193.21 | Num_heavy_atoms: | 14 |
| TPSA: | 81.16 | NumAromaticRings: | 1 |
