Glycoside
...
GD000708

Name:
TERNSTROSIDE C

Formula:
C22H26O11

Smiles:
O=C(Cc1ccc(O)c(O)c1)O[C@H]1[C@H](O)[C@@H](OCCc2ccc(O)c(O)c2)O[C@@H](CO)[C@H]1O

Aglycone:
O=C(O)Cc1ccc(O)c(O)c1.OCCc1ccc(O)c(O)c1

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 7 FractionCSP3: 0.41
AlogP: -0.34 Num_rotatable_bonds: 8
MolWt: 466.44 Num_heavy_atoms: 33
TPSA: 186.37 NumAromaticRings: 2

Unique Aglycone
AD00128
Formula: C8H10O3

Smiles:
OCCc1ccc(O)c(O)c1
HBA: 3 RingCount: 1
HBD: 3 FractionCSP3: 0.25
AlogP: 0.63 Num_rotatable_bonds: 2
MolWt: 154.16 Num_heavy_atoms: 11
TPSA: 60.69 NumAromaticRings: 1
AD00758
Formula: C8H8O4

Smiles:
O=C(O)Cc1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.12
AlogP: 0.72 Num_rotatable_bonds: 2
MolWt: 168.15 Num_heavy_atoms: 12
TPSA: 77.76 NumAromaticRings: 1

Sugarmoiety
SD00003

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