Glycoside
GD009163
Name:
NoneFormula:
C11H16O5N2Smiles:
CCO[C@@H]1O[C@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1OAglycone:
Cc1c[nH]c(=O)[nH]c1=OSugarmoiety:
CCOC1OC(O)CC1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.26 | Num_heavy_atoms: | 18 |
| TPSA: | 93.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD00276
Formula: C5H6O2N2
Smiles:
Cc1c[nH]c(=O)[nH]c1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 126.11 | Num_heavy_atoms: | 9 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
