Glycoside
...
GD026772

Name:
None

Formula:
C25H33O11N3

Smiles:
O=C(O)CC[C@H](NC(=O)CC1OC(CNC(=O)C=CC(=O)NCCc2ccccc2)C(O)C(O)C1O)C(=O)O

Aglycone:
CC(=O)NC(CCC(=O)O)C(=O)O.CNC(=O)C=CC(=O)NCCc1ccccc1

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

Other Identifiers

Properties
HBA: 14 RingCount: 2
HBD: 8 FractionCSP3: 0.48
AlogP: -2.31 Num_rotatable_bonds: 14
MolWt: 551.55 Num_heavy_atoms: 39
TPSA: 231.82 NumAromaticRings: 1

Unique Aglycone
AD01099
Formula: C7H11O5N

Smiles:
CC(=O)NC(CCC(=O)O)C(=O)O
HBA: 6 RingCount: 0
HBD: 3 FractionCSP3: 0.57
AlogP: -0.56 Num_rotatable_bonds: 5
MolWt: 189.17 Num_heavy_atoms: 13
TPSA: 103.7 NumAromaticRings: 0
AD17635
Formula: C13H16O2N2

Smiles:
CNC(=O)C=CC(=O)NCCc1ccccc1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.23
AlogP: 0.65 Num_rotatable_bonds: 5
MolWt: 232.28 Num_heavy_atoms: 17
TPSA: 58.2 NumAromaticRings: 1

Sugarmoiety
SD00017

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