Glycoside
...
GD036055

Name:
None

Formula:
C43H68O15

Smiles:
CC(=O)O[C@@H]1[C@@H]2O[C@]3(C(C)(C)O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)CC[C@](C)(O3)[C@H]2[C@]2(C)CC[C@@]34C[C@]35CC[C@H](O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@H]5CC[C@H]4[C@]12C

Aglycone:
CC(=O)OC1C2OC3(C(C)(C)O)CCC(C)(O3)C2C2(C)CCC34CC35CCC(O)C(C)(C)C5CCC4C12C

Sugarmoiety:
OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 9
HBD: 7 FractionCSP3: 0.98
AlogP: 1.66 Num_rotatable_bonds: 7
MolWt: 825.0 Num_heavy_atoms: 58
TPSA: 223.29 NumAromaticRings: 0

Unique Aglycone
AD17644
Formula: C32H50O6

Smiles:
CC(=O)OC1C2OC3(C(C)(C)O)CCC(C)(O3)C2C2(C)CCC34CC35CCC(O)C(C)(C)C5CCC4C12C
HBA: 6 RingCount: 7
HBD: 2 FractionCSP3: 0.97
AlogP: 5.37 Num_rotatable_bonds: 2
MolWt: 530.75 Num_heavy_atoms: 38
TPSA: 85.22 NumAromaticRings: 0

Sugarmoiety
SD00082

OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O