Glycoside

GD129893
Name:
d-ribosylnicotinic acidFormula:
C11H16O6NSmiles:
O=C(O)C1=C[NH+](C2OC(CO)C(O)C2O)CC=C1Aglycone:
O=C(O)C1=C[NH2+]CC=C1Sugarmoiety:
OCC1OC([OH+])C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 2 |
HBD: | 5 | FractionCSP3: | 0.55 |
AlogP: | -3.15 | Num_rotatable_bonds: | 3 |
MolWt: | 258.25 | Num_heavy_atoms: | 18 |
TPSA: | 111.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD52623
Formula: C6H8O2N
Smiles:
O=C(O)C1=C[NH2+]CC=C1HBA: | 3 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.17 |
AlogP: | -0.91 | Num_rotatable_bonds: | 1 |
MolWt: | 126.13 | Num_heavy_atoms: | 9 |
TPSA: | 53.91 | NumAromaticRings: | 0 |