Glycoside
...
GD100258

Name:
None

Formula:
C22H35O11N

Smiles:
COC(=O)CCCC[C@@H](C)N[C@H]1[C@H](OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(=O)CCCCC(C)N.COC(C)=O

Sugarmoiety:
CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 12 RingCount: 1
HBD: 1 FractionCSP3: 0.77
AlogP: 0.78 Num_rotatable_bonds: 12
MolWt: 489.52 Num_heavy_atoms: 34
TPSA: 152.76 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
AD26682
Formula: C8H17O2N

Smiles:
COC(=O)CCCCC(C)N
HBA: 3 RingCount: 0
HBD: 2 FractionCSP3: 0.88
AlogP: 1.07 Num_rotatable_bonds: 5
MolWt: 159.23 Num_heavy_atoms: 11
TPSA: 52.32 NumAromaticRings: 0

Sugarmoiety
SD00215

CC(=O)OCC1OOC(O)C(OC(C)=O)C1OC(C)=O