Glycoside
...
GD022679

Name:
None

Formula:
C14H26O6N2

Smiles:
CO[C@H](C(=O)NCC(N)=O)[C@H](O)[C@H](O)[C@H](O)C=CC(C)(C)C

Aglycone:
C=CC(C)(C)C.NCC(N)=O

Sugarmoiety:
COC(C(=O)O)C(O)C(O)C(O)O

Other Identifiers

Properties
HBA: 8 RingCount: 0
HBD: 6 FractionCSP3: 0.71
AlogP: -1.71 Num_rotatable_bonds: 8
MolWt: 318.37 Num_heavy_atoms: 22
TPSA: 142.11 NumAromaticRings: 0

Unique Aglycone
AD00410
Formula: C6H12

Smiles:
C=CC(C)(C)C
HBA: 0 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 2.22 Num_rotatable_bonds: 0
MolWt: 84.16 Num_heavy_atoms: 6
TPSA: 0.0 NumAromaticRings: 0
AD05023
Formula: C2H6ON2

Smiles:
NCC(N)=O
HBA: 3 RingCount: 0
HBD: 4 FractionCSP3: 0.5
AlogP: -1.57 Num_rotatable_bonds: 1
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 69.11 NumAromaticRings: 0

Sugarmoiety
SD00152

COC(C(=O)O)C(O)C(O)C(O)O