Glycoside
...
GD122397

Name:
3,5-dihydroxy-2-(hydroxymethyl)-6-(2,3,4-trihydroxybenzoyloxy)oxan-4-yl 11,12,13-trihydroxy-5,8-dioxo-7-oxatricyclo[7.4.0.0²,⁶]trideca-1(13),9,11-triene-3-carboxylate

Formula:
C26H24O17

Smiles:
O=C(OC1OC(CO)C(O)C(OC(=O)C2CC(=O)C3OC(=O)c4cc(O)c(O)c(O)c4C23)C1O)c1ccc(O)c(O)c1O

Aglycone:
O=C(O)c1ccc(O)c(O)c1O.O=C1OC2C(=O)CC(C(=O)O)C2c2c1cc(O)c(O)c2O

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

Other Identifiers

Properties
HBA: 17 RingCount: 5
HBD: 9 FractionCSP3: 0.38
AlogP: -1.66 Num_rotatable_bonds: 5
MolWt: 608.46 Num_heavy_atoms: 43
TPSA: 287.27 NumAromaticRings: 2

Unique Aglycone
AD14557
Formula: C7H6O5

Smiles:
O=C(O)c1ccc(O)c(O)c1O
HBA: 5 RingCount: 1
HBD: 4 FractionCSP3: 0.0
AlogP: 0.5 Num_rotatable_bonds: 1
MolWt: 170.12 Num_heavy_atoms: 12
TPSA: 97.99 NumAromaticRings: 1
AD49318
Formula: C13H10O8

Smiles:
O=C1OC2C(=O)CC(C(=O)O)C2c2c1cc(O)c(O)c2O
HBA: 8 RingCount: 3
HBD: 4 FractionCSP3: 0.31
AlogP: 0.1 Num_rotatable_bonds: 1
MolWt: 294.22 Num_heavy_atoms: 21
TPSA: 141.36 NumAromaticRings: 1

Sugarmoiety
SD00003

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