Glycoside
...
GD148502

Name:
6-[4,4,6a,6b,8a,11,11,14b-octamethyl-14-oxo-9-(3,4,5-trihydroxy-6-methyloxan-2-yl)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]-5-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3,4-dihydroxyoxane-2-carboxylic acid

Formula:
C48H74O17

Smiles:
CC1OC(C2CC(C)(C)CC3C4=CC(=O)C5C6(C)CCC(C7OC(C(=O)O)C(O)C(O)C7OC7OC(C(=O)O)C(O)C(O)C7O)C(C)(C)C6CCC5(C)C4(C)CCC32C)C(O)C(O)C1O

Aglycone:
CC1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCCC(C)(C)C5CCC43C)C2C1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.O=C(O)C1OC(OC2C(O)OC(C(=O)O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 10 FractionCSP3: 0.9
AlogP: 1.55 Num_rotatable_bonds: 6
MolWt: 923.1 Num_heavy_atoms: 65
TPSA: 290.43 NumAromaticRings: 0

Unique Aglycone
AD59424
Formula: C30H48O

Smiles:
CC1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCCC(C)(C)C5CCC43C)C2C1
HBA: 1 RingCount: 5
HBD: 0 FractionCSP3: 0.9
AlogP: 8.38 Num_rotatable_bonds: 0
MolWt: 424.71 Num_heavy_atoms: 31
TPSA: 17.07 NumAromaticRings: 0

Sugarmoiety
SD02939

CC1OC(O)C(O)C(O)C1O.O=C(O)C1OC(OC2C(O)OC(C(=O)O)C(O)C2O)C(O)C(O)C1O