Glycoside
...
GD007465

Name:
None

Formula:
C59H106O16N4

Smiles:
CCCCCCCCCCCCCCCCOC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](NC(=O)[C@@H]1C[C@H](O)CN1C(=O)CCCC(=O)O)[C@H](C)O[C@@H]1O[C@H](C)[C@H](O)C(O)C1O)C(=O)OCCCCCCCCCCCCCCCC

Aglycone:
CCCCCCCCCCCCCCCCOC(=O)CCC(NC(=O)CNC(=O)C(NC(=O)C1CC(O)CN1C(=O)CCCC(=O)O)C(C)O)C(=O)OCCCCCCCCCCCCCCCC

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 2
HBD: 8 FractionCSP3: 0.88
AlogP: 7.35 Num_rotatable_bonds: 47
MolWt: 1127.51 Num_heavy_atoms: 79
TPSA: 296.89 NumAromaticRings: 0

Unique Aglycone
AD06082
Formula: C53H96O12N4

Smiles:
CCCCCCCCCCCCCCCCOC(=O)CCC(NC(=O)CNC(=O)C(NC(=O)C1CC(O)CN1C(=O)CCCC(=O)O)C(C)O)C(=O)OCCCCCCCCCCCCCCCC
HBA: 16 RingCount: 1
HBD: 6 FractionCSP3: 0.87
AlogP: 8.5 Num_rotatable_bonds: 45
MolWt: 981.37 Num_heavy_atoms: 69
TPSA: 237.97 NumAromaticRings: 0

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O