Glycoside
...
GD128214

Name:
Rhamnakoside A

Formula:
C36H40O21

Smiles:
COc1cc(OCC2OC(Oc3cc(O)c4c(c3)COC4=O)C(O)C(O)C2O)ccc1OC1OC(COc2cc(OC)c(OC(=O)O)c(OC)c2)C(O)C(O)C1O

Aglycone:
COc1cc(OC)c(OC(=O)O)c(OC)c1.COc1ccc(O)c(OC)c1.O=C1OCc2cc(O)cc(O)c21

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

Other Identifiers

Properties
HBA: 21 RingCount: 6
HBD: 8 FractionCSP3: 0.44
AlogP: -0.32 Num_rotatable_bonds: 14
MolWt: 808.7 Num_heavy_atoms: 57
TPSA: 297.51 NumAromaticRings: 3

Unique Aglycone
AD11587
Formula: C8H6O4

Smiles:
O=C1OCc2cc(O)cc(O)c21
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.12
AlogP: 0.77 Num_rotatable_bonds: 0
MolWt: 166.13 Num_heavy_atoms: 12
TPSA: 66.76 NumAromaticRings: 1
AD50362
Formula: C8H10O3

Smiles:
COc1ccc(O)c(OC)c1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.25
AlogP: 1.41 Num_rotatable_bonds: 2
MolWt: 154.16 Num_heavy_atoms: 11
TPSA: 38.69 NumAromaticRings: 1
AD51940
Formula: C10H12O6

Smiles:
COc1cc(OC)c(OC(=O)O)c(OC)c1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.3
AlogP: 1.77 Num_rotatable_bonds: 4
MolWt: 228.2 Num_heavy_atoms: 16
TPSA: 74.22 NumAromaticRings: 1

Sugarmoiety
SD00041

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