Glycoside
...
GD106971

Name:
None

Formula:
C28H45O14N

Smiles:
CC(=O)N[C@H]1[C@H](OC[C@H](O)[C@H]2O[C@@H]3OC(C)(C)O[C@@H]3[C@H]2OCCC(C)C)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
CC(C)CCOC1C(C(O)CO)OC2OC(C)(C)OC21.COC(C)=O

Sugarmoiety:
CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 2 FractionCSP3: 0.86
AlogP: 0.33 Num_rotatable_bonds: 13
MolWt: 619.66 Num_heavy_atoms: 43
TPSA: 183.61 NumAromaticRings: 0

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD40415
Formula: C14H26O6

Smiles:
CC(C)CCOC1C(C(O)CO)OC2OC(C)(C)OC21
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 1.0
AlogP: 0.65 Num_rotatable_bonds: 6
MolWt: 290.36 Num_heavy_atoms: 20
TPSA: 77.38 NumAromaticRings: 0

Sugarmoiety
SD00131

CC(=O)NC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O