Glycoside
...
GD028866

Name:
None

Formula:
C42H72O13

Smiles:
C[C@@H]1C[C@H](O)[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]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]2[C@]1(C)O

Aglycone:
CC1CC(O)C2(C)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1(C)O

Sugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 7
HBD: 9 FractionCSP3: 1.0
AlogP: 1.84 Num_rotatable_bonds: 6
MolWt: 785.03 Num_heavy_atoms: 55
TPSA: 218.99 NumAromaticRings: 0

Unique Aglycone
AD18821
Formula: C30H52O3

Smiles:
CC1CC(O)C2(C)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1(C)O
HBA: 3 RingCount: 5
HBD: 3 FractionCSP3: 1.0
AlogP: 6.19 Num_rotatable_bonds: 0
MolWt: 460.74 Num_heavy_atoms: 33
TPSA: 60.69 NumAromaticRings: 0

Sugarmoiety
SD00114

OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O