Glycoside
GD147408
Name:
NoneFormula:
C27H49O12NSmiles:
CCCCCCCCCCCCC(O)C(O)C(COC1OC(CC(C(=O)O)C(=O)O)C(O)C(O)C1O)N=C(C)OAglycone:
CC(C(=O)O)C(=O)O.CCCCCCCCCCCCC(O)C(O)C(CO)N=C(C)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.89 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 21 |
| MolWt: | 579.68 | Num_heavy_atoms: | 40 |
| TPSA: | 226.8 | NumAromaticRings: | 0 |
Unique Aglycone
AD15845
Formula: C4H6O4
Smiles:
CC(C(=O)O)C(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 118.09 | Num_heavy_atoms: | 8 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
AD51318
Formula: C18H37O4N
Smiles:
CCCCCCCCCCCCC(O)C(O)C(CO)N=C(C)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 3.36 | Num_rotatable_bonds: | 15 |
| MolWt: | 331.5 | Num_heavy_atoms: | 23 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
