Glycoside
...
GD130150

Name:
6-acetyl-5-hydroxy-7-methyl-4-{[3,4,5-trihydroxy-6-(1-hydroxycyclohexyl)oxan-2-yl]oxy}naphthalene-2-carboxylic acid

Formula:
C25H30O10

Smiles:
CC(=O)c1c(C)cc2cc(C(=O)O)cc(OC3OC(C4(O)CCCCC4)C(O)C(O)C3O)c2c1O

Aglycone:
CC(=O)c1c(C)cc2cc(C(=O)O)cc(O)c2c1O.OC1CCCCC1

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

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 6 FractionCSP3: 0.52
AlogP: 1.64 Num_rotatable_bonds: 5
MolWt: 490.51 Num_heavy_atoms: 35
TPSA: 173.98 NumAromaticRings: 2

Unique Aglycone
AD06056
Formula: C6H12O

Smiles:
OC1CCCCC1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 1.0
AlogP: 1.31 Num_rotatable_bonds: 0
MolWt: 100.16 Num_heavy_atoms: 7
TPSA: 20.23 NumAromaticRings: 0
AD45063
Formula: C14H12O5

Smiles:
CC(=O)c1c(C)cc2cc(C(=O)O)cc(O)c2c1O
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.14
AlogP: 2.46 Num_rotatable_bonds: 2
MolWt: 260.24 Num_heavy_atoms: 19
TPSA: 94.83 NumAromaticRings: 2

Sugarmoiety
SD00017

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