Glycoside
...
GD037351

Name:
None

Formula:
C40H62O13

Smiles:
CC(=O)O[C@@H]1[C@H](CO)O[C@H](O[C@@H]2CC[C@@]34C[C@@]35CC[C@]3(C)[C@@H]6[C@H](C)C[C@H]([C@H](OC(C)=O)C(C)(C)O)O[C@@]6(O)[C@H](O)[C@@]3(C)C5=CC[C@H]4C2(C)C)[C@H](O)[C@H]1O

Aglycone:
CC(=O)OC(C1CC(C)C2C(O)(O1)C(O)C1(C)C3=CCC4C(C)(C)C(O)CCC45CC35CCC21C)C(C)(C)O

Sugarmoiety:
CC(=O)OC1C(CO)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 7
HBD: 6 FractionCSP3: 0.9
AlogP: 2.5 Num_rotatable_bonds: 7
MolWt: 750.92 Num_heavy_atoms: 53
TPSA: 201.67 NumAromaticRings: 0

Unique Aglycone
AD20050
Formula: C32H50O7

Smiles:
CC(=O)OC(C1CC(C)C2C(O)(O1)C(O)C1(C)C3=CCC4C(C)(C)C(O)CCC45CC35CCC21C)C(C)(C)O
HBA: 7 RingCount: 6
HBD: 4 FractionCSP3: 0.91
AlogP: 4.1 Num_rotatable_bonds: 3
MolWt: 546.75 Num_heavy_atoms: 39
TPSA: 116.45 NumAromaticRings: 0

Sugarmoiety
SD02455

CC(=O)OC1C(CO)OC(O)C(O)C1O