Glycoside
...
GD015221

Name:
None

Formula:
C39H66O16N4

Smiles:
CC(=O)N[C@@H]1C(O[C@@H]2O[C@H](C[C@H](O)[C@@H]3O[C@H](N4CCC(=O)NC4=O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2NC(=O)C=CCCCCCCCCCCC(C)C)OC(CO)[C@H](O)[C@H]1O

Aglycone:
CC(C)CCCCCCCCCCC=CC(N)=O.O=C1CCNC(=O)N1

Sugarmoiety:
CC(=O)NC1C(OC2OC(CC(O)C3OC(O)C(O)C3O)C(O)C(O)C2O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 4
HBD: 11 FractionCSP3: 0.85
AlogP: -1.87 Num_rotatable_bonds: 21
MolWt: 846.97 Num_heavy_atoms: 59
TPSA: 306.37 NumAromaticRings: 0

Unique Aglycone
AD01822
Formula: C4H6O2N2

Smiles:
O=C1CCNC(=O)N1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.5
AlogP: -0.78 Num_rotatable_bonds: 0
MolWt: 114.1 Num_heavy_atoms: 8
TPSA: 58.2 NumAromaticRings: 0
AD11083
Formula: C16H31ON

Smiles:
CC(C)CCCCCCCCCCC=CC(N)=O
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.81
AlogP: 4.58 Num_rotatable_bonds: 12
MolWt: 253.43 Num_heavy_atoms: 18
TPSA: 43.09 NumAromaticRings: 0

Sugarmoiety
SD00454

CC(=O)NC1C(OC2OC(CC(O)C3OC(O)C(O)C3O)C(O)C(O)C2O)OC(CO)C(O)C1O