Glycoside
...
GD135140

Name:
Cibotiumbaroside A

Formula:
C18H20O11

Smiles:
O=C1OCC=C1COC1OC(COC(=O)c2ccc(O)c(O)c2)C(O)C(O)C1O

Aglycone:
COC(=O)c1ccc(O)c(O)c1.O=C1OCC=C1CO

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

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.44
AlogP: -1.44 Num_rotatable_bonds: 6
MolWt: 412.35 Num_heavy_atoms: 29
TPSA: 172.21 NumAromaticRings: 1

Unique Aglycone
AD01079
Formula: C5H6O3

Smiles:
O=C1OCC=C1CO
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.4
AlogP: -0.54 Num_rotatable_bonds: 1
MolWt: 114.1 Num_heavy_atoms: 8
TPSA: 46.53 NumAromaticRings: 0
AD13436
Formula: C8H8O4

Smiles:
COC(=O)c1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 0.88 Num_rotatable_bonds: 1
MolWt: 168.15 Num_heavy_atoms: 12
TPSA: 66.76 NumAromaticRings: 1

Sugarmoiety
SD00017

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