Glycoside

GD093115
Name:
[3,4,5-tris(acetyloxy)-6-(2-methylphenoxy)oxan-2-yl]methyl acetateFormula:
C21H26O10Smiles:
CC(=O)OC[C@H]1O[C@@H](Oc2ccccc2C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.Cc1ccccc1OSugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 10 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 0.52 |
AlogP: | 1.46 | Num_rotatable_bonds: | 7 |
MolWt: | 438.43 | Num_heavy_atoms: | 31 |
TPSA: | 123.66 | 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 |
AD02445
Formula: C7H8O
Smiles:
Cc1ccccc1OHBA: | 1 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.14 |
AlogP: | 1.7 | Num_rotatable_bonds: | 0 |
MolWt: | 108.14 | Num_heavy_atoms: | 8 |
TPSA: | 20.23 | NumAromaticRings: | 1 |