Glycoside
GD021348
Name:
NoneFormula:
C18H24O7N2Smiles:
O=C(O)C(NCCC1OC(CO)C(O)C(O)C1O)c1cc2ccccc2[nH]1Aglycone:
CCNC(C(=O)O)c1cc2ccccc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 7 |
| MolWt: | 380.4 | Num_heavy_atoms: | 27 |
| TPSA: | 155.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD14614
Formula: C12H14O2N2
Smiles:
CCNC(C(=O)O)c1cc2ccccc2[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 218.26 | Num_heavy_atoms: | 16 |
| TPSA: | 65.12 | NumAromaticRings: | 2 |
