Glycoside
...
GD028436

Name:
None

Formula:
C19H32O12N4

Smiles:
C[C@H](NC(=O)[C@H](C)O[C@H]1[C@H](NC(=O)CO)C(O)O[C@@H](CO)[C@H]1O)C(=O)N[C@H](CCC(=O)O)C(N)=O

Aglycone:
CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=O.NC(=O)CO

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 1
HBD: 10 FractionCSP3: 0.74
AlogP: -5.35 Num_rotatable_bonds: 13
MolWt: 508.48 Num_heavy_atoms: 35
TPSA: 267.07 NumAromaticRings: 0

Unique Aglycone
AD00987
Formula: C11H19O6N3

Smiles:
CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(N)=O
HBA: 9 RingCount: 0
HBD: 6 FractionCSP3: 0.64
AlogP: -2.29 Num_rotatable_bonds: 8
MolWt: 289.29 Num_heavy_atoms: 20
TPSA: 158.82 NumAromaticRings: 0
AD03871
Formula: C2H5O2N

Smiles:
NC(=O)CO
HBA: 3 RingCount: 0
HBD: 3 FractionCSP3: 0.5
AlogP: -1.54 Num_rotatable_bonds: 1
MolWt: 75.07 Num_heavy_atoms: 5
TPSA: 63.32 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O