Glycoside

GD036438
Name:
NoneFormula:
C31H32O10N6Smiles:
CC(=O)C[C@@H]1O[C@H](On2cc(CN3C(=O)C(=NNc4ccccc4)c4ccccc43)nn2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
O=C1C(=NNc2ccccc2)c2ccccc2N1Cc1cn(O)nn1Sugarmoiety:
CC(=O)CC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 16 | RingCount: | 5 |
HBD: | 1 | FractionCSP3: | 0.35 |
AlogP: | 1.57 | Num_rotatable_bonds: | 11 |
MolWt: | 648.63 | Num_heavy_atoms: | 47 |
TPSA: | 189.84 | NumAromaticRings: | 3 |
Unique Aglycone
AD09431
Formula: C17H14O2N6
Smiles:
O=C1C(=NNc2ccccc2)c2ccccc2N1Cc1cn(O)nn1HBA: | 8 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.06 |
AlogP: | 1.88 | Num_rotatable_bonds: | 4 |
MolWt: | 334.34 | Num_heavy_atoms: | 25 |
TPSA: | 95.64 | NumAromaticRings: | 3 |