Glycoside
...
GD137840

Name:
4,15-bis(acetyloxy)-14-hydroxy-2,14,17-trimethyl-3-oxo-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecan-16-yl 2H-1,3-benzodioxole-5-carboxylate

Formula:
C37H48O17

Smiles:
CC(=O)OC1CCC2CC3OC(OC4OC(CO)C(O)C(O)C4O)CC4C(C)(O)C(OC(C)=O)C(OC(=O)c5ccc6c(c5)OCO6)C(C2(C)C1=O)C34C

Aglycone:
CC(=O)OC1CCC2CC3OC(O)CC4C(C)(O)C(OC(C)=O)C(OC(=O)c5ccc6c(c5)OCO6)C(C2(C)C1=O)C34C

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

Other Identifiers

Properties
HBA: 17 RingCount: 7
HBD: 5 FractionCSP3: 0.73
AlogP: 0.13 Num_rotatable_bonds: 7
MolWt: 764.77 Num_heavy_atoms: 54
TPSA: 243.27 NumAromaticRings: 1

Unique Aglycone
AD55668
Formula: C31H38O12

Smiles:
CC(=O)OC1CCC2CC3OC(O)CC4C(C)(O)C(OC(C)=O)C(OC(=O)c5ccc6c(c5)OCO6)C(C2(C)C1=O)C34C
HBA: 12 RingCount: 6
HBD: 2 FractionCSP3: 0.68
AlogP: 2.3 Num_rotatable_bonds: 4
MolWt: 602.63 Num_heavy_atoms: 43
TPSA: 164.12 NumAromaticRings: 1

Sugarmoiety
SD00003

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