Glycoside
...
GD016562

Name:
None

Formula:
C29H34O10N4

Smiles:
CCCC=C1C(=O)N(Cc2cn([C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)nn2)c2ccccc21

Aglycone:
CCCC=C1C(=O)N(CC2=C[N]N=N2)c2ccccc21.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 0 FractionCSP3: 0.48
AlogP: 2.26 Num_rotatable_bonds: 10
MolWt: 598.61 Num_heavy_atoms: 43
TPSA: 165.45 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD11908
Formula: C15H15ON4

Smiles:
CCCC=C1C(=O)N(CC2=C[N]N=N2)c2ccccc21
HBA: 5 RingCount: 3
HBD: 0 FractionCSP3: 0.27
AlogP: 3.04 Num_rotatable_bonds: 4
MolWt: 267.31 Num_heavy_atoms: 20
TPSA: 59.13 NumAromaticRings: 1

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O