Glycoside
...
GD106935

Name:
None

Formula:
C24H29O12N

Smiles:
CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)Cc2ccccc2OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
CC(=O)Oc1ccccc1CC(N)=O.COC(C)=O

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 1 FractionCSP3: 0.5
AlogP: 0.35 Num_rotatable_bonds: 9
MolWt: 523.49 Num_heavy_atoms: 37
TPSA: 169.83 NumAromaticRings: 1

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
AD44234
Formula: C10H11O3N

Smiles:
CC(=O)Oc1ccccc1CC(N)=O
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.2
AlogP: 0.64 Num_rotatable_bonds: 3
MolWt: 193.2 Num_heavy_atoms: 14
TPSA: 69.39 NumAromaticRings: 1

Sugarmoiety
SD00889

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O