Glycoside
...
GD131352

Name:
Cp 96797

Formula:
C47H80O17

Smiles:
COC1CCC(OC2C(C)C(C3CCC(C4CCC(C5(C)CC(C)C6(OC(CC7OC(O)(C(O)C(=O)O)C(C)C(OC)C7(C)OC)CC(OC)C6C)O5)O4)O3)OC(C)(O)C2C)OC1C

Aglycone:
COC1CCC(OC2C(C)C(C3CCC(C4CCC(C5(C)CC(C)C6(OC(C)CC(OC)C6C)O5)O4)O3)OC(C)(O)C2C)OC1C.O=C(O)CO

Sugarmoiety:
COC1C(C)C(O)(O)OC(O)C1(C)OC

Other Identifiers

Properties
HBA: 17 RingCount: 7
HBD: 4 FractionCSP3: 0.98
AlogP: 4.32 Num_rotatable_bonds: 13
MolWt: 917.14 Num_heavy_atoms: 64
TPSA: 208.75 NumAromaticRings: 0

Unique Aglycone
AD02329
Formula: C2H4O3

Smiles:
O=C(O)CO
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 0.5
AlogP: -0.94 Num_rotatable_bonds: 1
MolWt: 76.05 Num_heavy_atoms: 5
TPSA: 57.53 NumAromaticRings: 0
AD53219
Formula: C36H62O10

Smiles:
COC1CCC(OC2C(C)C(C3CCC(C4CCC(C5(C)CC(C)C6(OC(C)CC(OC)C6C)O5)O4)O3)OC(C)(O)C2C)OC1C
HBA: 10 RingCount: 6
HBD: 1 FractionCSP3: 1.0
AlogP: 5.36 Num_rotatable_bonds: 7
MolWt: 654.88 Num_heavy_atoms: 46
TPSA: 103.3 NumAromaticRings: 0

Sugarmoiety
SD05716

COC1C(C)C(O)(O)OC(O)C1(C)OC