Glycoside

GD013134
Name:
NoneFormula:
C32H48O16N4SSmiles:
CN(C)c1cccc2c(S(=O)(=O)N(CCO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)CC(=O)N(CCO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)CC(N)=O)cccc12Aglycone:
CN(C)c1cccc2c(S(=O)(=O)N(CCO)CC(=O)N(CCO)CC(N)=O)cccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 20 | RingCount: | 4 |
HBD: | 10 | FractionCSP3: | 0.62 |
AlogP: | -5.16 | Num_rotatable_bonds: | 17 |
MolWt: | 776.82 | Num_heavy_atoms: | 53 |
TPSA: | 302.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD09842
Formula: C20H28O6N4S
Smiles:
CN(C)c1cccc2c(S(=O)(=O)N(CCO)CC(=O)N(CCO)CC(N)=O)cccc12HBA: | 10 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.4 |
AlogP: | -0.8 | Num_rotatable_bonds: | 11 |
MolWt: | 452.53 | Num_heavy_atoms: | 31 |
TPSA: | 144.48 | NumAromaticRings: | 2 |