Glycoside

GD010901
Name:
NoneFormula:
C23H36O13N4Smiles:
CC(=O)NC1C(O)OC(C(COC(C)=O)OC(C)=O)C1OC(C)C(=O)N[C@H](C)C(=O)NC(CCC(=O)O)C(N)=OAglycone:
CC(=O)OCCOC(C)=O.CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=OSugarmoiety:
CC(=O)NC1C(O)OC(O)C1OOther Identifiers
Properties
HBA: | 17 | RingCount: | 1 |
HBD: | 7 | FractionCSP3: | 0.7 |
AlogP: | -3.18 | Num_rotatable_bonds: | 15 |
MolWt: | 576.56 | Num_heavy_atoms: | 40 |
TPSA: | 258.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD00987
Formula: C11H19O6N3
Smiles:
CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=OHBA: | 9 | RingCount: | 0 |
HBD: | 6 | FractionCSP3: | 0.64 |
AlogP: | -2.29 | Num_rotatable_bonds: | 8 |
MolWt: | 289.29 | Num_heavy_atoms: | 20 |
TPSA: | 158.82 | NumAromaticRings: | 0 |
AD05458
Formula: C6H10O4
Smiles:
CC(=O)OCCOC(C)=OHBA: | 4 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.11 | Num_rotatable_bonds: | 3 |
MolWt: | 146.14 | Num_heavy_atoms: | 10 |
TPSA: | 52.6 | NumAromaticRings: | 0 |