Glycoside
...
GD123478

Name:
2,6-dihydroxy-3-({14-hydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl}oxy)cyclohexyl acetate

Formula:
C44H72O14

Smiles:
CC(=O)OC1C(O)CCC(OC2CCC34CC35CCC3(C)C(C6(C)CCC(C(C)(C)O)O6)C(O)CC3(C)C5CC(OC3OC(CO)C(O)C(O)C3O)C4C2(C)C)C1O

Aglycone:
CC(=O)OC1C(O)CCC(OC2CCC34CC35CCC3(C)C(C6(C)CCC(C(C)(C)O)O6)C(O)CC3(C)C5CC(O)C4C2(C)C)C1O

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

Other Identifiers

Properties
HBA: 14 RingCount: 8
HBD: 8 FractionCSP3: 0.98
AlogP: 2.1 Num_rotatable_bonds: 8
MolWt: 825.05 Num_heavy_atoms: 58
TPSA: 225.06 NumAromaticRings: 0

Unique Aglycone
AD49837
Formula: C38H62O9

Smiles:
CC(=O)OC1C(O)CCC(OC2CCC34CC35CCC3(C)C(C6(C)CCC(C(C)(C)O)O6)C(O)CC3(C)C5CC(O)C4C2(C)C)C1O
HBA: 9 RingCount: 7
HBD: 5 FractionCSP3: 0.97
AlogP: 4.28 Num_rotatable_bonds: 5
MolWt: 662.91 Num_heavy_atoms: 47
TPSA: 145.91 NumAromaticRings: 0

Sugarmoiety
SD00003

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