Glycoside
...
GD133029

Name:
6a,6b,8a,11,11,14b-hexamethyl-4-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4-carboxylic acid

Formula:
C36H58O8

Smiles:
CC1(C)CCC2(C)CCC3(C)C(=CCC4C5(C)CCCC(COC6OC(CO)C(O)C(O)C6O)(C(=O)O)C5CCC43C)C2C1

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

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 6
HBD: 5 FractionCSP3: 0.92
AlogP: 5.06 Num_rotatable_bonds: 5
MolWt: 618.85 Num_heavy_atoms: 44
TPSA: 136.68 NumAromaticRings: 0

Unique Aglycone
AD53854
Formula: C30H48O3

Smiles:
CC1(C)CCC2(C)CCC3(C)C(=CCC4C5(C)CCCC(CO)(C(=O)O)C5CCC43C)C2C1
HBA: 3 RingCount: 5
HBD: 2 FractionCSP3: 0.9
AlogP: 7.24 Num_rotatable_bonds: 2
MolWt: 456.71 Num_heavy_atoms: 33
TPSA: 57.53 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O