Glycoside
...
GD003959

Name:
None

Formula:
C57H104O31N8

Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCCOCCOCCNC(=O)CCOCC(COCCC(=O)NCCOCCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)(COCCC(=O)NCCOCCOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)NC(=O)CN

Aglycone:
NCC(=O)NC(COCCC(=O)NCCOCCOCCO)(COCCC(=O)NCCOCCOCCO)COCCC(=O)NCCOCCOCCO

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

Other Identifiers

Properties
HBA: 39 RingCount: 3
HBD: 18 FractionCSP3: 0.88
AlogP: -10.65 Num_rotatable_bonds: 53
MolWt: 1397.48 Num_heavy_atoms: 96
TPSA: 550.24 NumAromaticRings: 0

Unique Aglycone
AD03524
Formula: C33H65O16N5

Smiles:
NCC(=O)NC(COCCC(=O)NCCOCCOCCO)(COCCC(=O)NCCOCCOCCO)COCCC(=O)NCCOCCOCCO
HBA: 21 RingCount: 0
HBD: 9 FractionCSP3: 0.88
AlogP: -4.55 Num_rotatable_bonds: 41
MolWt: 787.9 Num_heavy_atoms: 54
TPSA: 286.18 NumAromaticRings: 0

Sugarmoiety
SD00390

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