Glycoside
...
GD152075

Name:
6-acetyl-4-{[5-heptyl-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-7-methylnaphthalene-2-carboxylic acid

Formula:
C27H36O10

Smiles:
CCCCCCCC1(O)C(CO)OC(Oc2cc(C(=O)O)cc3cc(C)c(C(C)=O)c(O)c23)C(O)C1O

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

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1(O)O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 6 FractionCSP3: 0.56
AlogP: 2.66 Num_rotatable_bonds: 11
MolWt: 520.58 Num_heavy_atoms: 37
TPSA: 173.98 NumAromaticRings: 2

Unique Aglycone
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
AD52427
Formula: C7H16

Smiles:
CCCCCCC
HBA: 0 RingCount: 0
HBD: 0 FractionCSP3: 1.0
AlogP: 2.98 Num_rotatable_bonds: 4
MolWt: 100.2 Num_heavy_atoms: 7
TPSA: 0.0 NumAromaticRings: 0

Sugarmoiety
SD04299

OCC1OC(O)C(O)C(O)C1(O)O