Glycoside
...
GD121241

Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 10-{[4-({3,5-dihydroxy-6-methyl-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-3,5-dihydroxyoxan-2-yl]oxy}-2,2,6a,6b,9,9,12a-heptamethyl-docosahydropicene-4a-carboxylate

Formula:
C52H86O20

Smiles:
CC1OC(OC2C(O)COC(OC3CCC4(C)C(CCC5(C)C4CCC4C6CC(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)C)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O

Aglycone:
CC1(C)CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

Sugarmoiety:
CC1OC(OC2C(O)COC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 9
HBD: 11 FractionCSP3: 0.98
AlogP: 0.35 Num_rotatable_bonds: 9
MolWt: 1031.24 Num_heavy_atoms: 72
TPSA: 313.44 NumAromaticRings: 0

Unique Aglycone
AD48782
Formula: C30H50O3

Smiles:
CC1(C)CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
HBA: 3 RingCount: 5
HBD: 2 FractionCSP3: 0.97
AlogP: 7.31 Num_rotatable_bonds: 1
MolWt: 458.73 Num_heavy_atoms: 33
TPSA: 57.53 NumAromaticRings: 0

Sugarmoiety
SD05782

CC1OC(OC2C(O)COC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O.OCC1OC(O)C(O)C(O)C1O