Glycoside
...
GD010837

Name:
None

Formula:
C71H100O12

Smiles:
CCCCCC[C@H](O)CCC[C@H](OC[C@@H]1O[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)[C@@H]1CC[C@H]([C@@H]2CC[C@H]([C@H](O)CCCCCCCCCCCCC3=C[C@H](C)OC3=O)O2)O1

Aglycone:
CCCCCCC(O)CCCC(OC)C1CCC(C2CCC(C(O)CCCCCCCCCCCCC3=CC(C)OC3=O)O2)O1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1

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

Other Identifiers

Properties
HBA: 12 RingCount: 8
HBD: 2 FractionCSP3: 0.62
AlogP: 14.58 Num_rotatable_bonds: 40
MolWt: 1145.57 Num_heavy_atoms: 83
TPSA: 140.6 NumAromaticRings: 4

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
AD08318
Formula: C38H68O7

Smiles:
CCCCCCC(O)CCCC(OC)C1CCC(C2CCC(C(O)CCCCCCCCCCCCC3=CC(C)OC3=O)O2)O1
HBA: 7 RingCount: 3
HBD: 2 FractionCSP3: 0.92
AlogP: 8.51 Num_rotatable_bonds: 26
MolWt: 636.96 Num_heavy_atoms: 45
TPSA: 94.45 NumAromaticRings: 0

Sugarmoiety
SD00017

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