Glycoside
...
GD139651

Name:
4-(acetyloxy)-1,12,15-trihydroxy-10,14,17,17-tetramethyl-11-oxo-9-[(3,4,5-trihydroxyoxan-2-yl)oxy]-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl benzoate

Formula:
C34H44O14

Smiles:
CC(=O)OC12COC1CC(OC1OCC(O)C(O)C1O)C1(C)C(=O)C(O)C3=C(C)C(O)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C

Aglycone:
CC(=O)OC12COC1CC(O)C1(C)C(=O)C(O)C3=C(C)C(O)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C

Sugarmoiety:
OC1COC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 6 FractionCSP3: 0.68
AlogP: -0.45 Num_rotatable_bonds: 5
MolWt: 676.71 Num_heavy_atoms: 48
TPSA: 218.74 NumAromaticRings: 1

Unique Aglycone
AD56314
Formula: C29H36O10

Smiles:
CC(=O)OC12COC1CC(O)C1(C)C(=O)C(O)C3=C(C)C(O)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C
HBA: 10 RingCount: 5
HBD: 4 FractionCSP3: 0.62
AlogP: 1.08 Num_rotatable_bonds: 3
MolWt: 544.6 Num_heavy_atoms: 39
TPSA: 159.82 NumAromaticRings: 1

Sugarmoiety
SD00050

OC1COC(O)C(O)C1O