Glycoside
...
GD033495

Name:
None

Formula:
C46H78O28N4S

Smiles:
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCCCCCC(=O)N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H]2O)[C@H]1O

Aglycone:
NC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21

Sugarmoiety:
OCC1OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC4C(O)C(CO)OC(OC5C(O)OC(CO)C(O)C5O)C4O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 32 RingCount: 7
HBD: 20 FractionCSP3: 0.93
AlogP: -10.4 Num_rotatable_bonds: 25
MolWt: 1167.2 Num_heavy_atoms: 79
TPSA: 506.08 NumAromaticRings: 0

Unique Aglycone
AD07372
Formula: C16H28O3N4S

Smiles:
NC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21
HBA: 7 RingCount: 2
HBD: 5 FractionCSP3: 0.81
AlogP: 0.87 Num_rotatable_bonds: 11
MolWt: 356.49 Num_heavy_atoms: 24
TPSA: 113.32 NumAromaticRings: 0

Sugarmoiety
SD01621

OCC1OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC4C(O)C(CO)OC(OC5C(O)OC(CO)C(O)C5O)C4O)C3O)C2O)C(O)C(O)C1O