Glycoside
GD076470
Name:
NoneFormula:
C16H27O8N3Smiles:
CC(C)(C)OC(=O)N(CCC#N)CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N(CCC#N)CC(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 6 |
| MolWt: | 389.41 | Num_heavy_atoms: | 27 |
| TPSA: | 172.58 | NumAromaticRings: | 0 |
Unique Aglycone
AD35261
Formula: C10H17O3N3
Smiles:
CC(C)(C)OC(=O)N(CCC#N)CC(N)=O| HBA: | 6 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 227.26 | Num_heavy_atoms: | 16 |
| TPSA: | 96.42 | NumAromaticRings: | 0 |
