Glycoside
...
GD016351

Name:
None

Formula:
C26H44O8N2

Smiles:
CO[C@H](C(=O)NC1CC[C@H](OC(=O)CC2CCCCC2)CNC1=O)[C@H](O)[C@H](O)[C@H](O)C=CC(C)(C)C

Aglycone:
C=CC(C)(C)C.NC1CCC(OC(=O)CC2CCCCC2)CNC1=O

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

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 5 FractionCSP3: 0.81
AlogP: 0.96 Num_rotatable_bonds: 10
MolWt: 512.64 Num_heavy_atoms: 36
TPSA: 154.42 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
AD11789
Formula: C14H24O3N2

Smiles:
NC1CCC(OC(=O)CC2CCCCC2)CNC1=O
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.86
AlogP: 1.11 Num_rotatable_bonds: 3
MolWt: 268.36 Num_heavy_atoms: 19
TPSA: 81.42 NumAromaticRings: 0

Sugarmoiety
SD00152

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