Glycoside

GD155853
Name:
{6-[2-(2H-1,3-benzodioxol-5-yl)ethoxy]-3,4,5-trihydroxyoxan-2-yl}methyl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C24H26O11Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OCC1OC(OCCc2ccc3c(c2)OCO3)C(O)C(O)C1OAglycone:
COC(=O)C=Cc1ccc(O)c(O)c1.OCCc1ccc2c(c1)OCO2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.38 |
AlogP: | 0.45 | Num_rotatable_bonds: | 8 |
MolWt: | 490.46 | Num_heavy_atoms: | 35 |
TPSA: | 164.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD03431
Formula: C10H10O4
Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1HBA: | 4 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.1 |
AlogP: | 1.28 | Num_rotatable_bonds: | 2 |
MolWt: | 194.19 | Num_heavy_atoms: | 14 |
TPSA: | 66.76 | NumAromaticRings: | 1 |
AD61770
Formula: C9H10O3
Smiles:
OCCc1ccc2c(c1)OCO2HBA: | 3 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.33 |
AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
MolWt: | 166.18 | Num_heavy_atoms: | 12 |
TPSA: | 38.69 | NumAromaticRings: | 1 |