Glycoside
GD046821
Name:
5,7-dimethyl-2-(1,2,3,4-tetrahydroxybutyl)-1,3-diazatricyclo[3.3.1.1³,â·]decan-6-oneFormula:
C14H24O5N2Smiles:
C[C@]12CN3C[C@](C)(CN(C1)[C@H]3[C@H](O)[C@H](O)[C@H](O)CO)C2=OAglycone:
CC12CN3CN(C1)CC(C)(C3)C2=OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 300.36 | Num_heavy_atoms: | 21 |
| TPSA: | 104.47 | NumAromaticRings: | 0 |
Unique Aglycone
AD25412
Formula: C10H16ON2
Smiles:
CC12CN3CN(C1)CC(C)(C3)C2=O| HBA: | 3 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.9 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 0 |
| MolWt: | 180.25 | Num_heavy_atoms: | 13 |
| TPSA: | 23.55 | NumAromaticRings: | 0 |
