Glycoside
...
GD095878

Name:
None

Formula:
C10H21O15N2P3

Smiles:
CO[C@@H]1[C@H](c2c[nH]c(=O)[nH]c2=O)O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H]1O

Aglycone:
CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:
COC1C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 2
HBD: 9 FractionCSP3: 0.6
AlogP: -3.19 Num_rotatable_bonds: 9
MolWt: 502.2 Num_heavy_atoms: 30
TPSA: 270.55 NumAromaticRings: 1

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD40402
Formula: CH11O10P3

Smiles:
CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O
HBA: 10 RingCount: 0
HBD: 6 FractionCSP3: 1.0
AlogP: -1.45 Num_rotatable_bonds: 5
MolWt: 276.01 Num_heavy_atoms: 14
TPSA: 166.14 NumAromaticRings: 0

Sugarmoiety
SD00354

COC1C(O)OC(O)C1O