Glycoside
...
GD015789

Name:
None

Formula:
C15H28O9

Smiles:
COC1C(COC(C)C)O[C@H](OCC(=O)O)C(OCCO)[C@H]1OC

Aglycone:
COC(C)C.O=C(O)CO

Sugarmoiety:
COOC(OCCO)C(O)OOCOC(C)C

Other Identifiers

Properties
HBA: 9 RingCount: 1
HBD: 2 FractionCSP3: 0.93
AlogP: -0.35 Num_rotatable_bonds: 11
MolWt: 352.38 Num_heavy_atoms: 24
TPSA: 112.91 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
AD03491
Formula: C4H10O

Smiles:
COC(C)C
HBA: 1 RingCount: 0
HBD: 0 FractionCSP3: 1.0
AlogP: 1.04 Num_rotatable_bonds: 1
MolWt: 74.12 Num_heavy_atoms: 5
TPSA: 9.23 NumAromaticRings: 0

Sugarmoiety
SD00794

COOC(OCCO)C(O)OOCOC(C)C