Glycoside
...
GD006981

Name:
Bartoloside K

Formula:
C37H60O6Cl2

Smiles:
CCCCCCC(Cl)CCCCCc1cc(O)c(CCCCCC(Cl)CCCCCC)c(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c1

Aglycone:
CCCCCCC(Cl)CCCCCc1cc(O)c(CCCCCC(Cl)CCCCCC)c(O)c1

Sugarmoiety:
OC1COC(O)C(O)C1O

Other Identifiers

Properties
HBA: 6 RingCount: 2
HBD: 4 FractionCSP3: 0.83
AlogP: 8.57 Num_rotatable_bonds: 24
MolWt: 647.77 Num_heavy_atoms: 43
TPSA: 99.38 NumAromaticRings: 1

Unique Aglycone
AD05715
Formula: C32H52O2Cl2

Smiles:
CCCCCCC(Cl)CCCCCc1cc(O)c(CCCCCC(Cl)CCCCCC)c(O)c1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.8
AlogP: 10.46 Num_rotatable_bonds: 22
MolWt: 515.65 Num_heavy_atoms: 34
TPSA: 40.46 NumAromaticRings: 1

Sugarmoiety
SD00050

OC1COC(O)C(O)C1O