Glycoside

GD137623
Name:
7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,13,21-triazapentacyclo[11.8.0.0²,¹â°.0â´,â¹.0¹âµ,²â°]henicosa-1(21),2(10),4,6,8,15,17,19-octaen-14-oneFormula:
C24H23O7N3Smiles:
O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccc(OC3OC(CO)C(O)C(O)C3O)cc12Aglycone:
O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccc(O)cc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 6 |
HBD: | 5 | FractionCSP3: | 0.33 |
AlogP: | 0.28 | Num_rotatable_bonds: | 3 |
MolWt: | 465.46 | Num_heavy_atoms: | 34 |
TPSA: | 150.06 | NumAromaticRings: | 4 |
Unique Aglycone
AD55589
Formula: C18H13O2N3
Smiles:
O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccc(O)cc12HBA: | 5 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.11 |
AlogP: | 2.81 | Num_rotatable_bonds: | 0 |
MolWt: | 303.32 | Num_heavy_atoms: | 23 |
TPSA: | 70.91 | NumAromaticRings: | 4 |