Glycoside
...
GD108480

Name:
None

Formula:
C27H32O11N

Smiles:
[NH3+]CCCCCC(=O)OC[C@@H]1O[C@H](Oc2ccc(-c3coc4cc(O)cc(O)c4c3=O)cc2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
COC(=O)CCCCC[NH3+].O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12

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

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 8 FractionCSP3: 0.41
AlogP: 0.4 Num_rotatable_bonds: 10
MolWt: 546.55 Num_heavy_atoms: 39
TPSA: 203.76 NumAromaticRings: 3

Unique Aglycone
AD02603
Formula: C15H10O5

Smiles:
O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12
HBA: 5 RingCount: 3
HBD: 3 FractionCSP3: 0.0
AlogP: 2.58 Num_rotatable_bonds: 1
MolWt: 270.24 Num_heavy_atoms: 20
TPSA: 90.9 NumAromaticRings: 3
AD44373
Formula: C7H16O2N

Smiles:
COC(=O)CCCCC[NH3+]
HBA: 3 RingCount: 0
HBD: 3 FractionCSP3: 0.86
AlogP: -0.04 Num_rotatable_bonds: 5
MolWt: 146.21 Num_heavy_atoms: 10
TPSA: 53.94 NumAromaticRings: 0

Sugarmoiety
SD00017

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