Glycoside
...
GD036936

Name:
2-(hydroxymethyl)-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl 4-methoxybenzoate

Formula:
C23H28O12

Smiles:
COc1ccc(C(=O)O[C@H]2[C@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3[C@]3(CO)O[C@@H]23)cc1

Aglycone:
COc1ccc(C(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 5
HBD: 5 FractionCSP3: 0.61
AlogP: -1.72 Num_rotatable_bonds: 7
MolWt: 496.47 Num_heavy_atoms: 35
TPSA: 176.9 NumAromaticRings: 1

Unique Aglycone
AD23287
Formula: C17H18O7

Smiles:
COc1ccc(C(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1
HBA: 7 RingCount: 4
HBD: 2 FractionCSP3: 0.47
AlogP: 0.46 Num_rotatable_bonds: 4
MolWt: 334.32 Num_heavy_atoms: 24
TPSA: 97.75 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O