Glycoside

GD109180
Name:
[3,4,5-tris(acetyloxy)-6-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]oxan-2-yl]methyl acetateFormula:
C26H30O12Smiles:
CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(C)c(C)c(=O)oc3c2C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.Cc1c(C)c2ccc(O)c(C)c2oc1=OSugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
HBA: | 12 | RingCount: | 3 |
HBD: | 0 | FractionCSP3: | 0.5 |
AlogP: | 2.18 | Num_rotatable_bonds: | 7 |
MolWt: | 534.51 | Num_heavy_atoms: | 38 |
TPSA: | 153.87 | 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 |
AD01676
Formula: C12H12O3
Smiles:
Cc1c(C)c2ccc(O)c(C)c2oc1=OHBA: | 3 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.25 |
AlogP: | 2.42 | Num_rotatable_bonds: | 0 |
MolWt: | 204.22 | Num_heavy_atoms: | 15 |
TPSA: | 50.44 | NumAromaticRings: | 2 |