Glycoside

GD094950
Name:
NoneFormula:
C20H26O10N4Smiles:
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](Nc2ccc(CC(N)=O)nn2)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.NC(=O)Cc1ccc(N)nn1Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.55 |
AlogP: | -1.0 | Num_rotatable_bonds: | 9 |
MolWt: | 482.45 | Num_heavy_atoms: | 34 |
TPSA: | 195.33 | 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 |
AD40576
Formula: C6H8ON4
Smiles:
NC(=O)Cc1ccc(N)nn1HBA: | 5 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.17 |
AlogP: | -0.91 | Num_rotatable_bonds: | 2 |
MolWt: | 152.16 | Num_heavy_atoms: | 11 |
TPSA: | 94.89 | NumAromaticRings: | 1 |