Glycoside
...
GD137235

Name:
Isoscutellarein 4'-Methyl Ether 8-(6''-N-Butylglucuronide)

Formula:
C26H28O12

Smiles:
CCCCOC(=O)C1OC(Oc2c(O)cc(O)c3c(=O)cc(-c4ccc(OC)cc4)oc23)C(O)C(O)C1O

Aglycone:
CCCCOC=O.COc1ccc(-c2cc(=O)c3c(O)cc(O)c(O)c3o2)cc1

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 5 FractionCSP3: 0.38
AlogP: 1.41 Num_rotatable_bonds: 8
MolWt: 532.5 Num_heavy_atoms: 38
TPSA: 185.35 NumAromaticRings: 3

Unique Aglycone
AD01542
Formula: C5H10O2

Smiles:
CCCCOC=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.8
AlogP: 0.96 Num_rotatable_bonds: 4
MolWt: 102.13 Num_heavy_atoms: 7
TPSA: 26.3 NumAromaticRings: 0
AD51377
Formula: C16H12O6

Smiles:
COc1ccc(-c2cc(=O)c3c(O)cc(O)c(O)c3o2)cc1
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

Sugarmoiety
SD00017

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