Glycoside

GD073882
Name:
NoneFormula:
C17H23O7N3Smiles:
COc1cccc(-c2cn(CCO[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)nn2)c1Aglycone:
COc1cccc(-c2cn(CCO)nn2)c1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.53 |
AlogP: | -1.23 | Num_rotatable_bonds: | 8 |
MolWt: | 381.38 | Num_heavy_atoms: | 27 |
TPSA: | 139.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD34179
Formula: C11H13O2N3
Smiles:
COc1cccc(-c2cn(CCO)nn2)c1HBA: | 5 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.27 |
AlogP: | 0.95 | Num_rotatable_bonds: | 4 |
MolWt: | 219.24 | Num_heavy_atoms: | 16 |
TPSA: | 60.17 | NumAromaticRings: | 2 |