Glycoside
...
GD107407

Name:
None

Formula:
C25H30O11N2

Smiles:
CC(=O)N[C@H]1[C@@H](OCCCN2C(=O)c3ccccc3C2=O)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
COC(C)=O.O=C1c2ccccc2C(=O)N1CCCO

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 1 FractionCSP3: 0.52
AlogP: 0.35 Num_rotatable_bonds: 10
MolWt: 534.52 Num_heavy_atoms: 38
TPSA: 163.84 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
AD36273
Formula: C11H11O3N

Smiles:
O=C1c2ccccc2C(=O)N1CCCO
HBA: 4 RingCount: 2
HBD: 1 FractionCSP3: 0.27
AlogP: 0.67 Num_rotatable_bonds: 3
MolWt: 205.21 Num_heavy_atoms: 15
TPSA: 57.61 NumAromaticRings: 1

Sugarmoiety
SD00131

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