Glycoside
...
GD019198

Name:
None

Formula:
C41H32O21

Smiles:
O=C(OC[C@@H]1O[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H]1OC(=O)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1

Aglycone:
COC(=O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1

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

Other Identifiers

Properties
HBA: 21 RingCount: 6
HBD: 10 FractionCSP3: 0.15
AlogP: 3.16 Num_rotatable_bonds: 11
MolWt: 860.69 Num_heavy_atoms: 62
TPSA: 343.03 NumAromaticRings: 5

Unique Aglycone
AD13436
Formula: C8H8O4

Smiles:
COC(=O)c1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 0.88 Num_rotatable_bonds: 1
MolWt: 168.15 Num_heavy_atoms: 12
TPSA: 66.76 NumAromaticRings: 1
AD13437
Formula: C7H6O4

Smiles:
O=C(O)c1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: 0.8 Num_rotatable_bonds: 1
MolWt: 154.12 Num_heavy_atoms: 11
TPSA: 77.76 NumAromaticRings: 1

Sugarmoiety
SD00017

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