Glycoside

GD035554
Name:
NoneFormula:
C22H29O9N3Smiles:
CCCCCCOC(c1ccc([N+](=O)[O-])cc1)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
CCCCCCOC(c1ccc([N+](=O)[O-])cc1)c1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.55 |
AlogP: | 0.74 | Num_rotatable_bonds: | 11 |
MolWt: | 479.49 | Num_heavy_atoms: | 34 |
TPSA: | 177.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD22490
Formula: C17H21O5N3
Smiles:
CCCCCCOC(c1ccc([N+](=O)[O-])cc1)c1c[nH]c(=O)[nH]c1=OHBA: | 8 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.41 |
AlogP: | 2.66 | Num_rotatable_bonds: | 9 |
MolWt: | 347.37 | Num_heavy_atoms: | 25 |
TPSA: | 118.09 | NumAromaticRings: | 2 |