Glycoside
...
GD019080

Name:
None

Formula:
C25H27O10N

Smiles:
COC(=O)Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](C)[C@H](OC)[C@H](OC(=O)c4ccc(C)[nH]4)[C@H]3O)ccc12

Aglycone:
COC(=O)Cc1cc(=O)oc2cc(O)ccc12.Cc1ccc(C(=O)O)[nH]1

Sugarmoiety:
COC1C(C)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 2 FractionCSP3: 0.4
AlogP: 1.87 Num_rotatable_bonds: 7
MolWt: 501.49 Num_heavy_atoms: 36
TPSA: 146.52 NumAromaticRings: 3

Unique Aglycone
AD00152
Formula: C6H7O2N

Smiles:
Cc1ccc(C(=O)O)[nH]1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.17
AlogP: 1.02 Num_rotatable_bonds: 1
MolWt: 125.13 Num_heavy_atoms: 9
TPSA: 53.09 NumAromaticRings: 1
AD13365
Formula: C12H10O5

Smiles:
COC(=O)Cc1cc(=O)oc2cc(O)ccc12
HBA: 5 RingCount: 2
HBD: 1 FractionCSP3: 0.17
AlogP: 1.21 Num_rotatable_bonds: 2
MolWt: 234.21 Num_heavy_atoms: 17
TPSA: 76.74 NumAromaticRings: 2

Sugarmoiety
SD00158

COC1C(C)OC(O)C(O)C1O