Glycoside
...
GD146044

Name:
4,5-dihydroxy-2-{[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-6-(methoxycarbonyl)oxan-3-yl 1-methyl propanedioate

Formula:
C27H26O15

Smiles:
COC(=O)CC(=O)OC1C(Oc2cc(O)c3c(=O)cc(-c4ccc(OC)c(O)c4)oc3c2)OC(C(=O)OC)C(O)C1O

Aglycone:
COC(=O)CC(=O)O.COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O

Sugarmoiety:
COC(=O)C1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 4 FractionCSP3: 0.33
AlogP: 0.35 Num_rotatable_bonds: 8
MolWt: 590.49 Num_heavy_atoms: 42
TPSA: 217.72 NumAromaticRings: 3

Unique Aglycone
AD04393
Formula: C16H12O6

Smiles:
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.06
AlogP: 2.59 Num_rotatable_bonds: 2
MolWt: 300.27 Num_heavy_atoms: 22
TPSA: 100.13 NumAromaticRings: 3
AD04733
Formula: C4H6O4

Smiles:
COC(=O)CC(=O)O
HBA: 4 RingCount: 0
HBD: 1 FractionCSP3: 0.5
AlogP: -0.37 Num_rotatable_bonds: 2
MolWt: 118.09 Num_heavy_atoms: 8
TPSA: 63.6 NumAromaticRings: 0

Sugarmoiety
SD00150

COC(=O)C1OC(O)C(O)C(O)C1O