Glycoside
...
GD005711

Name:
None

Formula:
C18H21O9P

Smiles:
O=P(O)(O)O[C@H]1[C@H](Oc2ccc(-c3ccccc3)cc2)O[C@@H](CO)[C@@H](O)[C@H]1O

Aglycone:
O=P(O)(O)O.Oc1ccc(-c2ccccc2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 5 FractionCSP3: 0.33
AlogP: 0.65 Num_rotatable_bonds: 6
MolWt: 412.33 Num_heavy_atoms: 28
TPSA: 145.91 NumAromaticRings: 2

Unique Aglycone
AD00019
Formula: H3O4P

Smiles:
O=P(O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 0.0
AlogP: -0.93 Num_rotatable_bonds: 0
MolWt: 97.99 Num_heavy_atoms: 5
TPSA: 77.76 NumAromaticRings: 0
AD03225
Formula: C12H10O

Smiles:
Oc1ccc(-c2ccccc2)cc1
HBA: 1 RingCount: 2
HBD: 1 FractionCSP3: 0.0
AlogP: 3.06 Num_rotatable_bonds: 1
MolWt: 170.21 Num_heavy_atoms: 13
TPSA: 20.23 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O