Glycoside
...
GD016200

Name:
None

Formula:
C40H71O16N5

Smiles:
CC(=O)N[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCCCCCCCCCCCC(=O)O)C(C)C

Aglycone:
CC(C)C(NC(=O)C(N)C(C)O)C(=O)N1CCCC1C(=O)NCCCCCCCCCCCC(=O)O

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 21 RingCount: 3
HBD: 12 FractionCSP3: 0.88
AlogP: -2.28 Num_rotatable_bonds: 25
MolWt: 878.03 Num_heavy_atoms: 61
TPSA: 329.23 NumAromaticRings: 0

Unique Aglycone
AD11696
Formula: C26H48O6N4

Smiles:
CC(C)C(NC(=O)C(N)C(C)O)C(=O)N1CCCC1C(=O)NCCCCCCCCCCCC(=O)O
HBA: 10 RingCount: 1
HBD: 6 FractionCSP3: 0.85
AlogP: 1.93 Num_rotatable_bonds: 18
MolWt: 512.69 Num_heavy_atoms: 36
TPSA: 162.06 NumAromaticRings: 0

Sugarmoiety
SD00222

CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O