Glycoside
...
GD122700

Name:
6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 12-hydroxy-1-(3-hydroxyprop-1-en-2-yl)-5a,5b,8,8,11a-pentamethyl-9-{[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylate

Formula:
C54H88O24

Smiles:
C=C(CO)C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CC(O)C4C5(C)CCC(OC6C(O)C(O)OC(CO)C6O)C(C)(C)C5CCC43C)C12

Aglycone:
C=C(CO)C1CCC2(C(=O)O)CCC3(C)C(CC(O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C12

Sugarmoiety:
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 9
HBD: 15 FractionCSP3: 0.94
AlogP: -3.21 Num_rotatable_bonds: 13
MolWt: 1121.27 Num_heavy_atoms: 78
TPSA: 394.36 NumAromaticRings: 0

Unique Aglycone
AD12660
Formula: C30H48O5

Smiles:
C=C(CO)C1CCC2(C(=O)O)CCC3(C)C(CC(O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C12
HBA: 5 RingCount: 5
HBD: 4 FractionCSP3: 0.9
AlogP: 5.03 Num_rotatable_bonds: 3
MolWt: 488.71 Num_heavy_atoms: 35
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD02165

CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O