Glycoside
...
GD155571

Name:
6-{[8,10-bis(acetyloxy)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-9-[(2-methylbut-2-enoyl)oxy]-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-3-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]oxane-2-carboxylic acid

Formula:
C63H98O28

Smiles:
CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OC(COC8OC(C)C(O)C(O)C8O)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(OC(C)=O)C21CO

Aglycone:
CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(OC(C)=O)C21CO

Sugarmoiety:
CC1OC(OCC2OC(OC3C(O)C(C(=O)O)OC(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 9
HBD: 13 FractionCSP3: 0.87
AlogP: -0.87 Num_rotatable_bonds: 16
MolWt: 1303.45 Num_heavy_atoms: 91
TPSA: 432.8 NumAromaticRings: 0

Unique Aglycone
AD61700
Formula: C39H60O8

Smiles:
CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(OC(C)=O)C21CO
HBA: 8 RingCount: 5
HBD: 2 FractionCSP3: 0.82
AlogP: 6.71 Num_rotatable_bonds: 5
MolWt: 656.9 Num_heavy_atoms: 47
TPSA: 119.36 NumAromaticRings: 0

Sugarmoiety
SD10361

CC1OC(OCC2OC(OC3C(O)C(C(=O)O)OC(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O