Glycoside
...
GD000914

Name:
None

Formula:
C31H39O10N

Smiles:
CCCCCCCc1cc(O[C@@H]2O[C@H](C)[C@H](OC)[C@H](OC(=O)c3ccc(C)[nH]3)[C@H]2O)c(C)c2oc(=O)c(C(=O)O)cc12

Aglycone:
CCCCCCCc1cc(O)c(C)c2oc(=O)c(C(=O)O)cc12.Cc1ccc(C(=O)O)[nH]1

Sugarmoiety:
COC1C(C)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 3 FractionCSP3: 0.52
AlogP: 4.67 Num_rotatable_bonds: 12
MolWt: 585.65 Num_heavy_atoms: 42
TPSA: 157.52 NumAromaticRings: 3

Unique Aglycone
AD00152
Formula: C6H7O2N

Smiles:
Cc1ccc(C(=O)O)[nH]1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.17
AlogP: 1.02 Num_rotatable_bonds: 1
MolWt: 125.13 Num_heavy_atoms: 9
TPSA: 53.09 NumAromaticRings: 1
AD00958
Formula: C18H22O5

Smiles:
CCCCCCCc1cc(O)c(C)c2oc(=O)c(C(=O)O)cc12
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.44
AlogP: 4.02 Num_rotatable_bonds: 7
MolWt: 318.37 Num_heavy_atoms: 23
TPSA: 87.74 NumAromaticRings: 2

Sugarmoiety
SD00158

COC1C(C)OC(O)C(O)C1O