Glycoside
GD039780
Name:
3-(aminocarbonyl)-1-[(3r,4s,5r)-3,4-dihydroxy-5-methyltetrahydro-2-furanyl]pyridiniumFormula:
C11H18O4N2Smiles:
C[C@H]1OC(N2CC=CC(C(N)=O)C2)[C@H](O)[C@@H]1OAglycone:
NC(=O)C1C=CCNC1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.27 | Num_heavy_atoms: | 17 |
| TPSA: | 96.02 | NumAromaticRings: | 0 |
Unique Aglycone
AD24534
Formula: C6H10ON2
Smiles:
NC(=O)C1C=CCNC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 126.16 | Num_heavy_atoms: | 9 |
| TPSA: | 55.12 | NumAromaticRings: | 0 |
