Glycoside
...
GD137403

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

Formula:
C35H54O13

Smiles:
CC1(C)CCC2(C(=O)O)CCC3(CO)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(O)(C(=O)O)C5CCC43C)C2C1

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

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

Other Identifiers

Properties
HBA: 13 RingCount: 6
HBD: 9 FractionCSP3: 0.89
AlogP: 0.79 Num_rotatable_bonds: 6
MolWt: 682.8 Num_heavy_atoms: 48
TPSA: 234.67 NumAromaticRings: 0

Unique Aglycone
AD55513
Formula: C29H44O8

Smiles:
CC1(C)CCC2(C(=O)O)CCC3(CO)C(=CCC4C5(C)CC(O)C(O)C(O)(C(=O)O)C5CCC43C)C2C1
HBA: 8 RingCount: 5
HBD: 6 FractionCSP3: 0.86
AlogP: 2.97 Num_rotatable_bonds: 3
MolWt: 520.66 Num_heavy_atoms: 37
TPSA: 155.52 NumAromaticRings: 0

Sugarmoiety
SD00003

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