Glycoside
...
GD027210

Name:
None

Formula:
C39H52O11

Smiles:
CCC=CCC=CCC=CCCCCCCCC(=O)OC[C@@H]1O[C@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCC=CCC=CCC=CCCCCCCCC(=O)OC.O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 6 FractionCSP3: 0.49
AlogP: 5.94 Num_rotatable_bonds: 21
MolWt: 696.83 Num_heavy_atoms: 50
TPSA: 183.21 NumAromaticRings: 2

Unique Aglycone
AD01456
Formula: C15H14O5

Smiles:
O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O
HBA: 5 RingCount: 2
HBD: 4 FractionCSP3: 0.13
AlogP: 2.32 Num_rotatable_bonds: 4
MolWt: 274.27 Num_heavy_atoms: 20
TPSA: 97.99 NumAromaticRings: 2
AD17906
Formula: C19H32O2

Smiles:
CCC=CCC=CCC=CCCCCCCCC(=O)OC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.63
AlogP: 5.75 Num_rotatable_bonds: 13
MolWt: 292.46 Num_heavy_atoms: 21
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O