Glycoside
...
GD157035

Name:
[6-({4,5-dihydroxy-2-[(5-{2-hydroxy-1,7-dimethylbicyclo[2.2.1]heptan-7-yl}-2-methylpentyl)oxy]-6-(hydroxymethyl)oxan-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl acetate

Formula:
C29H50O13

Smiles:
CC(=O)OCC1OC(OC2C(OCC(C)CCCC3(C)C4CCC3(C)C(O)C4)OC(CO)C(O)C2O)C(O)C(O)C1O

Aglycone:
CC(CO)CCCC1(C)C2CCC1(C)C(O)C2.COC(C)=O

Sugarmoiety:
OCC1OC(O)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 7 FractionCSP3: 0.97
AlogP: -0.81 Num_rotatable_bonds: 12
MolWt: 606.71 Num_heavy_atoms: 42
TPSA: 204.83 NumAromaticRings: 0

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD47338
Formula: C15H28O2

Smiles:
CC(CO)CCCC1(C)C2CCC1(C)C(O)C2
HBA: 2 RingCount: 2
HBD: 2 FractionCSP3: 1.0
AlogP: 2.97 Num_rotatable_bonds: 5
MolWt: 240.39 Num_heavy_atoms: 17
TPSA: 40.46 NumAromaticRings: 0

Sugarmoiety
SD01057

OCC1OC(O)C(OC2OC(O)C(O)C(O)C2O)C(O)C1O