Glycoside
...
GD109034

Name:
None

Formula:
C29H33O12N

Smiles:
COc1cc(C(=O)NCc2ccccc2)ccc1O[C@@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.COc1cc(C(=O)NCc2ccccc2)ccc1O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 1 FractionCSP3: 0.41
AlogP: 2.09 Num_rotatable_bonds: 11
MolWt: 587.58 Num_heavy_atoms: 42
TPSA: 161.99 NumAromaticRings: 2

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
AD44511
Formula: C15H15O3N

Smiles:
COc1cc(C(=O)NCc2ccccc2)ccc1O
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.13
AlogP: 2.33 Num_rotatable_bonds: 4
MolWt: 257.29 Num_heavy_atoms: 19
TPSA: 58.56 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O