Glycoside

GD147229
Name:
4,5-dihydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxan-3-yl 3-(4-hydroxyphenyl)prop-2-enoateFormula:
C23H26O9Smiles:
O=C(C=Cc1ccc(O)cc1)OC1C(CO)OC(OCCc2ccc(O)cc2)C(O)C1OAglycone:
O=C(O)C=Cc1ccc(O)cc1.OCCc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.35 |
AlogP: | 0.72 | Num_rotatable_bonds: | 8 |
MolWt: | 446.45 | Num_heavy_atoms: | 32 |
TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD00021
Formula: C9H8O3
Smiles:
O=C(O)C=Cc1ccc(O)cc1HBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 1.49 | Num_rotatable_bonds: | 2 |
MolWt: | 164.16 | Num_heavy_atoms: | 12 |
TPSA: | 57.53 | NumAromaticRings: | 1 |
AD03863
Formula: C8H10O2
Smiles:
OCCc1ccc(O)cc1HBA: | 2 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.25 |
AlogP: | 0.93 | Num_rotatable_bonds: | 2 |
MolWt: | 138.17 | Num_heavy_atoms: | 10 |
TPSA: | 40.46 | NumAromaticRings: | 1 |