Glycoside
...
GD157881

Name:
Nikkomycin Lx

Formula:
C20H25O9N5

Smiles:
CC(C(N)C(O)=NC(C(=O)O)C1OC(n2cc(C=O)nc2O)C(O)C1O)C(O)c1ccccn1

Aglycone:
CC(C(N)C(O)=NCC(=O)O)C(O)c1ccccn1.O=CC1=C[N]C(O)=N1

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 8 FractionCSP3: 0.45
AlogP: -1.48 Num_rotatable_bonds: 9
MolWt: 479.45 Num_heavy_atoms: 34
TPSA: 233.84 NumAromaticRings: 2

Unique Aglycone
AD11626
Formula: C4H3O2N2

Smiles:
O=CC1=C[N]C(O)=N1
HBA: 4 RingCount: 1
HBD: 1 FractionCSP3: 0.0
AlogP: -0.44 Num_rotatable_bonds: 1
MolWt: 111.08 Num_heavy_atoms: 8
TPSA: 63.76 NumAromaticRings: 0
AD51251
Formula: C12H17O4N3

Smiles:
CC(C(N)C(O)=NCC(=O)O)C(O)c1ccccn1
HBA: 7 RingCount: 1
HBD: 5 FractionCSP3: 0.42
AlogP: 0.12 Num_rotatable_bonds: 6
MolWt: 267.29 Num_heavy_atoms: 19
TPSA: 129.03 NumAromaticRings: 1

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O