Glycoside
...
GD141954

Name:
{5,7',9',13'-tetramethyl-16'-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-14'-yl}oxidanesulfonic acid

Formula:
C33H52O11S

Smiles:
CC1CCC2(OC1)OC1CC3C4CC=C5CC(OC6OC(C)C(O)C(O)C6O)CC(OS(=O)(=O)O)C5(C)C4CCC3(C)C1C2C

Aglycone:
CC1CCC2(OC1)OC1CC3C4CC=C5CC(O)CC(OS(=O)(=O)O)C5(C)C4CCC3(C)C1C2C

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 7
HBD: 4 FractionCSP3: 0.94
AlogP: 3.36 Num_rotatable_bonds: 4
MolWt: 656.83 Num_heavy_atoms: 45
TPSA: 161.21 NumAromaticRings: 0

Unique Aglycone
AD57150
Formula: C27H42O7S

Smiles:
CC1CCC2(OC1)OC1CC3C4CC=C5CC(O)CC(OS(=O)(=O)O)C5(C)C4CCC3(C)C1C2C
HBA: 7 RingCount: 6
HBD: 2 FractionCSP3: 0.93
AlogP: 4.51 Num_rotatable_bonds: 2
MolWt: 510.69 Num_heavy_atoms: 35
TPSA: 102.29 NumAromaticRings: 0

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O