Glycoside
...
GD016379

Name:
None

Formula:
C47H78O14

Smiles:
C=C(C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]12

Aglycone:
C=C(C)C1CCC2(C)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12

Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 8
HBD: 8 FractionCSP3: 0.96
AlogP: 3.16 Num_rotatable_bonds: 8
MolWt: 867.13 Num_heavy_atoms: 61
TPSA: 217.22 NumAromaticRings: 0

Unique Aglycone
AD09208
Formula: C30H50O

Smiles:
C=C(C)C1CCC2(C)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12
HBA: 1 RingCount: 5
HBD: 1 FractionCSP3: 0.93
AlogP: 8.02 Num_rotatable_bonds: 1
MolWt: 426.73 Num_heavy_atoms: 31
TPSA: 20.23 NumAromaticRings: 0

Sugarmoiety
SD01349

CC1OC(OC2C(O)OC(CO)C(O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1O