Glycoside
...
GD115739

Name:
Nikkomycin Qx

Formula:
C24H32O12N6

Smiles:
CC(C(N)C(O)=NC(C(O)=NC(CCO)C(=O)O)C1OC(n2cc(C=O)nc2O)C(O)C1O)C(O)c1ccc(O)cn1

Aglycone:
CC(C(N)C(O)=NCC(O)=NC(CCO)C(=O)O)C(O)c1ccc(O)cn1.O=CC1=C[N]C(O)=N1

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 18 RingCount: 3
HBD: 11 FractionCSP3: 0.5
AlogP: -2.06 Num_rotatable_bonds: 13
MolWt: 596.55 Num_heavy_atoms: 42
TPSA: 306.89 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
AD45844
Formula: C16H24O7N4

Smiles:
CC(C(N)C(O)=NCC(O)=NC(CCO)C(=O)O)C(O)c1ccc(O)cn1
HBA: 11 RingCount: 1
HBD: 8 FractionCSP3: 0.5
AlogP: -0.47 Num_rotatable_bonds: 10
MolWt: 384.39 Num_heavy_atoms: 27
TPSA: 202.08 NumAromaticRings: 1

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O