Glycoside
...
GD036158

Name:
None

Formula:
C48H86O10N2

Smiles:
CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@H](CO[C@@H]1O[C@H](CNC(=O)CCc2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCC

Aglycone:
CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCC.CNC(=O)CCc1ccc(O)cc1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 2
HBD: 8 FractionCSP3: 0.83
AlogP: 7.65 Num_rotatable_bonds: 37
MolWt: 851.22 Num_heavy_atoms: 60
TPSA: 198.04 NumAromaticRings: 1

Unique Aglycone
AD15308
Formula: C33H67O4N

Smiles:
CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCC
HBA: 5 RingCount: 0
HBD: 4 FractionCSP3: 0.97
AlogP: 8.37 Num_rotatable_bonds: 30
MolWt: 541.9 Num_heavy_atoms: 38
TPSA: 89.79 NumAromaticRings: 0
AD22833
Formula: C10H13O2N

Smiles:
CNC(=O)CCc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.3
AlogP: 1.07 Num_rotatable_bonds: 3
MolWt: 179.22 Num_heavy_atoms: 13
TPSA: 49.33 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O