Glycoside
...
GD038690

Name:
6-cyclohexyl-2-(4-cyclohexylbutyl)-2-({[4-o-(alpha-d-glucopyranosyl)-beta-d-glucopyranosyl]oxy}methyl)hexyl 4-o-alpha-d-glucopyranosyl-beta-d-glucopyranoside

Formula:
C47H84O22

Smiles:
OC[C@H]1O[C@H](O[C@H]2[C@@H](CO)O[C@H](OCC(CCCCC3CCCCC3)(CCCCC3CCCCC3)CO[C@H]3O[C@H](CO)[C@H](O[C@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@@H]4O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1O

Aglycone:
OCC(CO)(CCCCC1CCCCC1)CCCCC1CCCCC1

Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 22 RingCount: 6
HBD: 14 FractionCSP3: 1.0
AlogP: -2.46 Num_rotatable_bonds: 24
MolWt: 1001.17 Num_heavy_atoms: 69
TPSA: 357.06 NumAromaticRings: 0

Unique Aglycone
AD24101
Formula: C23H44O2

Smiles:
OCC(CO)(CCCCC1CCCCC1)CCCCC1CCCCC1
HBA: 2 RingCount: 2
HBD: 2 FractionCSP3: 1.0
AlogP: 6.24 Num_rotatable_bonds: 12
MolWt: 352.6 Num_heavy_atoms: 25
TPSA: 40.46 NumAromaticRings: 0

Sugarmoiety
SD00625

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O