Glycoside

GD107219
Name:
NoneFormula:
C27H29O10N3Smiles:
COC(=O)c1ccc2ncc(C(=O)OC)c(Nc3cccc(O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]4NC(C)=O)c3)c2c1Aglycone:
COC(=O)c1ccc2ncc(C(=O)OC)c(Nc3cccc(O)c3)c2c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.33 |
AlogP: | 0.87 | Num_rotatable_bonds: | 8 |
MolWt: | 555.54 | Num_heavy_atoms: | 40 |
TPSA: | 185.77 | NumAromaticRings: | 3 |
Unique Aglycone
AD42280
Formula: C19H16O5N2
Smiles:
COC(=O)c1ccc2ncc(C(=O)OC)c(Nc3cccc(O)c3)c2c1HBA: | 7 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.11 |
AlogP: | 3.26 | Num_rotatable_bonds: | 4 |
MolWt: | 352.35 | Num_heavy_atoms: | 26 |
TPSA: | 97.75 | NumAromaticRings: | 3 |