Glycoside
...
GD008172

Name:
None

Formula:
C43H42O14F2

Smiles:
O=C(CCCCc1ccc(F)cc1)OC[C@@H]1O[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](OC(=O)CCCCc2ccc(F)cc2)[C@H](O)[C@H]1O

Aglycone:
COC(=O)CCCCc1ccc(F)cc1.O=C(O)CCCCc1ccc(F)cc1.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

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

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 6 FractionCSP3: 0.33
AlogP: 5.67 Num_rotatable_bonds: 16
MolWt: 820.79 Num_heavy_atoms: 59
TPSA: 222.65 NumAromaticRings: 5

Unique Aglycone
AD00377
Formula: C15H10O7

Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
HBA: 7 RingCount: 3
HBD: 5 FractionCSP3: 0.0
AlogP: 1.99 Num_rotatable_bonds: 1
MolWt: 302.24 Num_heavy_atoms: 22
TPSA: 131.36 NumAromaticRings: 3
AD06562
Formula: C12H15O2F

Smiles:
COC(=O)CCCCc1ccc(F)cc1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.42
AlogP: 2.71 Num_rotatable_bonds: 5
MolWt: 210.25 Num_heavy_atoms: 15
TPSA: 26.3 NumAromaticRings: 1
AD06563
Formula: C11H13O2F

Smiles:
O=C(O)CCCCc1ccc(F)cc1
HBA: 2 RingCount: 1
HBD: 1 FractionCSP3: 0.36
AlogP: 2.62 Num_rotatable_bonds: 5
MolWt: 196.22 Num_heavy_atoms: 14
TPSA: 37.3 NumAromaticRings: 1

Sugarmoiety
SD00017

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