Glycoside
GD139544
Name:
N-({3,4-dihydroxy-5-[(phenylcarbamoyl)methyl]oxolan-2-yl}methyl)morpholine-4-carboxamideFormula:
C18H25O6N3Smiles:
OC(CC1OC(CN=C(O)N2CCOCC2)C(O)C1O)=Nc1ccccc1Aglycone:
CC(O)=Nc1ccccc1.CN=C(O)N1CCOCC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 379.41 | Num_heavy_atoms: | 27 |
| TPSA: | 127.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD45684
Formula: C8H9ON
Smiles:
CC(O)=Nc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 135.17 | Num_heavy_atoms: | 10 |
| TPSA: | 32.59 | NumAromaticRings: | 1 |
AD46358
Formula: C6H12O2N2
Smiles:
CN=C(O)N1CCOCC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 0 |
| MolWt: | 144.17 | Num_heavy_atoms: | 10 |
| TPSA: | 45.06 | NumAromaticRings: | 0 |
