Glycoside
...
GD132490

Name:
1-(8-{[6-(1,3-dihydroxy-3-phenylpropyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-1-hydroxy-6-methoxy-3-methylnaphthalen-2-yl)ethan-1-one

Formula:
C28H32O10

Smiles:
COc1cc(OC2OC(C(O)CC(O)c3ccccc3)C(O)C(O)C2O)c2c(O)c(C(C)=O)c(C)cc2c1

Aglycone:
COc1cc(O)c2c(O)c(C(C)=O)c(C)cc2c1.OCCC(O)c1ccccc1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 6 FractionCSP3: 0.39
AlogP: 1.74 Num_rotatable_bonds: 8
MolWt: 528.55 Num_heavy_atoms: 38
TPSA: 166.14 NumAromaticRings: 3

Unique Aglycone
AD15787
Formula: C14H14O4

Smiles:
COc1cc(O)c2c(O)c(C(C)=O)c(C)cc2c1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.21
AlogP: 2.77 Num_rotatable_bonds: 2
MolWt: 246.26 Num_heavy_atoms: 18
TPSA: 66.76 NumAromaticRings: 2
AD53649
Formula: C9H12O2

Smiles:
OCCC(O)c1ccccc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.33
AlogP: 1.1 Num_rotatable_bonds: 3
MolWt: 152.19 Num_heavy_atoms: 11
TPSA: 40.46 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O