Glycoside
...
GD011105

Name:
None

Formula:
C25H32O8N2

Smiles:
CNC(=O)c1cccc(-c2ccc(O[C@@H]3O[C@H](COC(=O)CN(C)C)[C@H](O)[C@H](O)[C@H]3O)c(C)c2)c1

Aglycone:
CNC(=O)c1cccc(-c2ccc(O)c(C)c2)c1.COC(=O)CN(C)C

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 4 FractionCSP3: 0.44
AlogP: 0.31 Num_rotatable_bonds: 8
MolWt: 488.54 Num_heavy_atoms: 35
TPSA: 137.79 NumAromaticRings: 2

Unique Aglycone
AD05084
Formula: C15H15O2N

Smiles:
CNC(=O)c1cccc(-c2ccc(O)c(C)c2)c1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.13
AlogP: 2.73 Num_rotatable_bonds: 2
MolWt: 241.29 Num_heavy_atoms: 18
TPSA: 49.33 NumAromaticRings: 2
AD08513
Formula: C5H11O2N

Smiles:
COC(=O)CN(C)C
HBA: 3 RingCount: 0
HBD: 0 FractionCSP3: 0.8
AlogP: -0.28 Num_rotatable_bonds: 2
MolWt: 117.15 Num_heavy_atoms: 8
TPSA: 29.54 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O