Glycoside
GD115563
Name:
NoneFormula:
C28H48O12N2Smiles:
COC(C(=O)OC1CCC(N=C(O)C(OC)C(O)C(O)C(O)C=CC(C)C)C(O)=NC1)C(O)C(O)C(O)C=CC(C)CAglycone:
C=CC(C)C.C=CC(C)C.NC1CCCCN=C1OSugarmoiety:
COC(C(=O)O)C(O)C(O)C(O)O.COC(C(=O)OO)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.75 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 16 |
| MolWt: | 604.69 | Num_heavy_atoms: | 42 |
| TPSA: | 231.32 | NumAromaticRings: | 0 |
Unique Aglycone
AD00557
Formula: C5H10
Smiles:
C=CC(C)C| HBA: | 0 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.6 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 1 |
| MolWt: | 70.13 | Num_heavy_atoms: | 5 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
AD45740
Formula: C6H12ON2
Smiles:
NC1CCCCN=C1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 0 |
| MolWt: | 128.18 | Num_heavy_atoms: | 9 |
| TPSA: | 58.61 | NumAromaticRings: | 0 |
