Glycoside

GD104079
Name:
[3,4,5-tris(acetyloxy)-6-(quinolin-8-yloxy)oxan-2-yl]methyl acetateFormula:
C23H25O10NSmiles:
CC(=O)OC[C@@H]1O[C@@H](Oc2cccc3cccnc23)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
COC(C)=O.Oc1cccc2cccnc12Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 11 | RingCount: | 3 |
HBD: | 0 | FractionCSP3: | 0.43 |
AlogP: | 1.7 | Num_rotatable_bonds: | 7 |
MolWt: | 475.45 | Num_heavy_atoms: | 34 |
TPSA: | 136.55 | NumAromaticRings: | 2 |
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 |
AD15598
Formula: C9H7ON
Smiles:
Oc1cccc2cccnc12HBA: | 2 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.0 |
AlogP: | 1.94 | Num_rotatable_bonds: | 0 |
MolWt: | 145.16 | Num_heavy_atoms: | 11 |
TPSA: | 33.12 | NumAromaticRings: | 2 |