Glycoside
...
GD017611

Name:
None

Formula:
C27H29O13N

Smiles:
CCN(CC)C(=O)COC(=O)[C@@H]1O[C@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCN(CC)C(=O)COC=O.O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(O)c(O)c12

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

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 6 FractionCSP3: 0.37
AlogP: 0.17 Num_rotatable_bonds: 8
MolWt: 575.52 Num_heavy_atoms: 41
TPSA: 216.66 NumAromaticRings: 3

Unique Aglycone
AD00690
Formula: C15H10O6

Smiles:
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(O)c(O)c12
HBA: 6 RingCount: 3
HBD: 4 FractionCSP3: 0.0
AlogP: 2.28 Num_rotatable_bonds: 1
MolWt: 286.24 Num_heavy_atoms: 21
TPSA: 111.13 NumAromaticRings: 3
AD12553
Formula: C7H13O3N

Smiles:
CCN(CC)C(=O)COC=O
HBA: 4 RingCount: 0
HBD: 0 FractionCSP3: 0.71
AlogP: 0.03 Num_rotatable_bonds: 5
MolWt: 159.19 Num_heavy_atoms: 11
TPSA: 46.61 NumAromaticRings: 0

Sugarmoiety
SD00017

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