Glycoside

GD124218
Name:
3-(hydroxymethyl)-5-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-1-en-1-yl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran-7-yl acetateFormula:
C29H36O13Smiles:
COc1cc(C2Oc3c(OC(C)=O)cc(C=CCOC4OC(CO)C(O)C(O)C4O)cc3C2CO)cc(OC)c1OCAglycone:
COc1cc(C2Oc3c(OC(C)=O)cc(C=CCO)cc3C2CO)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.48 |
AlogP: | 0.68 | Num_rotatable_bonds: | 11 |
MolWt: | 592.59 | Num_heavy_atoms: | 42 |
TPSA: | 182.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD50170
Formula: C23H26O8
Smiles:
COc1cc(C2Oc3c(OC(C)=O)cc(C=CCO)cc3C2CO)cc(OC)c1OCHBA: | 8 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.35 |
AlogP: | 2.85 | Num_rotatable_bonds: | 8 |
MolWt: | 430.45 | Num_heavy_atoms: | 31 |
TPSA: | 103.68 | NumAromaticRings: | 2 |