Glycoside
...
GD033580

Name:
Cleistetroside 5

Formula:
C40H70O19

Smiles:
CCCCCCCCCCCCO[C@@H]1O[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](OC(C)=O)[C@H](O[C@@H]3O[C@H](C)[C@H](O)[C@H](O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)[C@H]3OC(C)=O)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:
CCCCCCCCCCCCO

Sugarmoiety:
CC(=O)OC1C(C)OC(OC2C(C)OC(O)C(O)C2O)C(O)C1OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC(C)=O

Other Identifiers

Properties
HBA: 19 RingCount: 4
HBD: 7 FractionCSP3: 0.95
AlogP: 0.45 Num_rotatable_bonds: 20
MolWt: 854.98 Num_heavy_atoms: 59
TPSA: 268.05 NumAromaticRings: 0

Unique Aglycone
AD00833
Formula: C12H26O

Smiles:
CCCCCCCCCCCCO
HBA: 1 RingCount: 0
HBD: 1 FractionCSP3: 1.0
AlogP: 3.9 Num_rotatable_bonds: 10
MolWt: 186.34 Num_heavy_atoms: 13
TPSA: 20.23 NumAromaticRings: 0

Sugarmoiety
SD03124

CC(=O)OC1C(C)OC(OC2C(C)OC(O)C(O)C2O)C(O)C1OC1OC(C)C(O)C(OC2OC(C)C(O)C(O)C2O)C1OC(C)=O