Glycoside
...
GD113745

Name:
None

Formula:
C48H42O10

Smiles:
O=C(O[C@@H](COCc1ccccc1)[C@H](OC(=O)c1ccccc1)[C@H](OC(=O)c1ccccc1)[C@@H](COCc1ccccc1)OC(=O)c1ccccc1)c1ccccc1

Aglycone:
Cc1ccccc1.Cc1ccccc1.O=Cc1ccccc1.O=Cc1ccccc1.O=Cc1ccccc1.O=Cc1ccccc1

Sugarmoiety:
OOCC(OO)C(OO)C(OO)C(COO)OO

Other Identifiers

Properties
HBA: 10 RingCount: 6
HBD: 0 FractionCSP3: 0.17
AlogP: 8.32 Num_rotatable_bonds: 19
MolWt: 778.85 Num_heavy_atoms: 58
TPSA: 123.66 NumAromaticRings: 6

Unique Aglycone
AD00274
Formula: C7H8

Smiles:
Cc1ccccc1
HBA: 0 RingCount: 1
HBD: 0 FractionCSP3: 0.14
AlogP: 2.0 Num_rotatable_bonds: 0
MolWt: 92.14 Num_heavy_atoms: 7
TPSA: 0.0 NumAromaticRings: 1
AD01696
Formula: C7H6O

Smiles:
O=Cc1ccccc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.0
AlogP: 1.5 Num_rotatable_bonds: 1
MolWt: 106.12 Num_heavy_atoms: 8
TPSA: 17.07 NumAromaticRings: 1

Sugarmoiety
SD01429

OOCC(OO)C(OO)C(OO)C(COO)OO