Glycoside
GD132814
Name:
Ckd 711AFormula:
C37H63O30NSmiles:
O=CC(O)C(O)C(OC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(NC5C(O)C(O)C(O)C6(CO)OC56)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)COAglycone:
NC1C(O)C(O)C(O)C2(CO)OC12Sugarmoiety:
O=CC(O)C(O)C(OC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)COOther Identifiers
Properties
| HBA: | 31 | RingCount: | 6 |
| HBD: | 21 | FractionCSP3: | 0.97 |
| AlogP: | -14.89 | Num_rotatable_bonds: | 20 |
| MolWt: | 1001.89 | Num_heavy_atoms: | 68 |
| TPSA: | 520.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD45438
Formula: C7H13O5N
Smiles:
NC1C(O)C(O)C(O)C2(CO)OC12| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -3.46 | Num_rotatable_bonds: | 1 |
| MolWt: | 191.18 | Num_heavy_atoms: | 13 |
| TPSA: | 119.47 | NumAromaticRings: | 0 |
Sugarmoiety
SD05896
O=CC(O)C(O)C(OC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)CO