Glycoside
...
GD031952

Name:
None

Formula:
C25H29O13N

Smiles:
O=C(O)CCC(=O)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O

Aglycone:
O=C(O)CCC(=O)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O)ccc1O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 9 FractionCSP3: 0.4
AlogP: -0.4 Num_rotatable_bonds: 11
MolWt: 551.5 Num_heavy_atoms: 39
TPSA: 243.54 NumAromaticRings: 2

Unique Aglycone
AD20536
Formula: C19H19O8N

Smiles:
O=C(O)CCC(=O)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O)ccc1O
HBA: 9 RingCount: 2
HBD: 6 FractionCSP3: 0.21
AlogP: 2.13 Num_rotatable_bonds: 8
MolWt: 389.36 Num_heavy_atoms: 28
TPSA: 164.39 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O