Glycoside

GD071230
Name:
NoneFormula:
C15H20O8N4Smiles:
CC(=O)OC[C@H]1O[C@@H](n2cnc(C(N)=O)c2N)[C@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.NC(=O)C1=C(N)[N]C=N1Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=OOther Identifiers
Properties
HBA: | 12 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.53 |
AlogP: | -1.11 | Num_rotatable_bonds: | 6 |
MolWt: | 384.35 | Num_heavy_atoms: | 27 |
TPSA: | 175.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD01700
Formula: C4H5ON4
Smiles:
NC(=O)C1=C(N)[N]C=N1HBA: | 5 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.0 |
AlogP: | -1.75 | Num_rotatable_bonds: | 1 |
MolWt: | 125.11 | Num_heavy_atoms: | 9 |
TPSA: | 95.57 | NumAromaticRings: | 0 |