Glycoside

GD091148
Name:
NoneFormula:
C22H30O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2=CC(C)(C)N(C(=O)c3ccccc3)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC1(C)C=C(C(=O)NCCO)CN1C(=O)c1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.55 |
AlogP: | -0.19 | Num_rotatable_bonds: | 6 |
MolWt: | 434.49 | Num_heavy_atoms: | 31 |
TPSA: | 128.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD39733
Formula: C16H20O3N2
Smiles:
CC1(C)C=C(C(=O)NCCO)CN1C(=O)c1ccccc1HBA: | 5 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.38 |
AlogP: | 0.96 | Num_rotatable_bonds: | 4 |
MolWt: | 288.35 | Num_heavy_atoms: | 21 |
TPSA: | 69.64 | NumAromaticRings: | 1 |