Glycoside

GD113696
Name:
NoneFormula:
C41H37O11N5Smiles:
O=C(Nc1ccccc1)OC[C@H]1O[C@@H](OC(=O)Nc2ccccc2)[C@@H](OC(=O)Nc2ccccc2)[C@@H](OC(=O)Nc2ccccc2)[C@H]1OC(=O)Nc1ccccc1Aglycone:
COC(=O)Nc1ccccc1.O=C(O)Nc1ccccc1.O=C(O)Nc1ccccc1.O=C(O)Nc1ccccc1.O=C(O)Nc1ccccc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 6 |
HBD: | 5 | FractionCSP3: | 0.15 |
AlogP: | 8.06 | Num_rotatable_bonds: | 11 |
MolWt: | 775.77 | Num_heavy_atoms: | 57 |
TPSA: | 200.88 | NumAromaticRings: | 5 |
Unique Aglycone
AD03528
Formula: C8H9O2N
Smiles:
COC(=O)Nc1ccccc1HBA: | 3 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.12 |
AlogP: | 1.86 | Num_rotatable_bonds: | 1 |
MolWt: | 151.16 | Num_heavy_atoms: | 11 |
TPSA: | 38.33 | NumAromaticRings: | 1 |
AD03530
Formula: C7H7O2N
Smiles:
O=C(O)Nc1ccccc1HBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 1.78 | Num_rotatable_bonds: | 1 |
MolWt: | 137.14 | Num_heavy_atoms: | 10 |
TPSA: | 49.33 | NumAromaticRings: | 1 |