Glycoside
...
GD025601

Name:
None

Formula:
C90H94O17

Smiles:
CCCCOc1ccc(C(=O)OC[C@@H]2O[C@H](O[C@@H]3O[C@H](COC(=O)c4ccc(OCCCC)cc4OCc4ccccc4)[C@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)[C@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)c(OCc2ccccc2)c1

Aglycone:
CCCCOc1ccc(C(=O)OC)c(OCc2ccccc2)c1.CCCCOc1ccc(C(=O)OC)c(OCc2ccccc2)c1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1

Sugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 12
HBD: 0 FractionCSP3: 0.31
AlogP: 17.19 Num_rotatable_bonds: 40
MolWt: 1447.73 Num_heavy_atoms: 107
TPSA: 172.59 NumAromaticRings: 10

Unique Aglycone
AD00044
Formula: C7H8O

Smiles:
OCc1ccccc1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 0.14
AlogP: 1.18 Num_rotatable_bonds: 1
MolWt: 108.14 Num_heavy_atoms: 8
TPSA: 20.23 NumAromaticRings: 1
AD16952
Formula: C19H22O4

Smiles:
CCCCOc1ccc(C(=O)OC)c(OCc2ccccc2)c1
HBA: 4 RingCount: 2
HBD: 0 FractionCSP3: 0.32
AlogP: 4.23 Num_rotatable_bonds: 8
MolWt: 314.38 Num_heavy_atoms: 23
TPSA: 44.76 NumAromaticRings: 2

Sugarmoiety
SD00200

OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O