Glycoside

GD136430
Name:
strepnoneside aFormula:
C32H36O14Smiles:
COC(=O)c1cc(O)c2c(c1)C(=O)c1cc(OC3CC(OC4CC(O)C(OC)C(C)O4)C(OC(C)=O)C(C)O3)c(C)c(O)c1C2=OAglycone:
COC(=O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(C)c(O)c1C2=OSugarmoiety:
COC1C(O)CC(OC2CC(O)OC(C)C2OC(C)=O)OC1COther Identifiers
Properties
HBA: | 14 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.5 |
AlogP: | 2.31 | Num_rotatable_bonds: | 7 |
MolWt: | 644.63 | Num_heavy_atoms: | 46 |
TPSA: | 193.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD55146
Formula: C17H12O7
Smiles:
COC(=O)c1cc(O)c2c(c1)C(=O)c1cc(O)c(C)c(O)c1C2=OHBA: | 7 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.12 |
AlogP: | 1.67 | Num_rotatable_bonds: | 1 |
MolWt: | 328.28 | Num_heavy_atoms: | 24 |
TPSA: | 121.13 | NumAromaticRings: | 2 |