Glycoside
GD047707
Name:
NoneFormula:
C13H21O6N3Smiles:
Cc1c[nH]nc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Cc1c[nH]nc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.33 | Num_heavy_atoms: | 22 |
| TPSA: | 136.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD25621
Formula: C7H11O2N3
Smiles:
Cc1c[nH]nc1C(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.18 | Num_heavy_atoms: | 12 |
| TPSA: | 78.01 | NumAromaticRings: | 1 |
