Glycoside
...
GD016086

Name:
None

Formula:
C21H40O8N6

Smiles:
CN[C@@H]1[C@H](O)[C@H](O[C@H]2[C@H](N)C[C@@H](N)[C@@H](O[C@@H]3OC(CNC(=O)CN)=CC[C@H]3N)[C@H]2O)OC[C@]1(C)O

Aglycone:
NCC(=O)NCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1

Sugarmoiety:
CNC1C(O)C(O)OCC1(C)O

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 13 FractionCSP3: 0.86
AlogP: -4.74 Num_rotatable_bonds: 8
MolWt: 504.59 Num_heavy_atoms: 35
TPSA: 242.82 NumAromaticRings: 0

Unique Aglycone
AD11620
Formula: C14H27O5N5

Smiles:
NCC(=O)NCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1
HBA: 10 RingCount: 2
HBD: 11 FractionCSP3: 0.79
AlogP: -3.82 Num_rotatable_bonds: 5
MolWt: 345.4 Num_heavy_atoms: 24
TPSA: 192.1 NumAromaticRings: 0

Sugarmoiety
SD00572

CNC1C(O)C(O)OCC1(C)O