Glycoside
GD001227
Name:
NoneFormula:
C30H49O12NSmiles:
C[C@@H]1O[C@H](O[C@@H]2C[C@H](O[C@@H]3O[C@H](C)[C@H](O)C[C@H]3O)[C@H](O[C@H](C)CCCCC(=O)NCc3ccco3)O[C@H]2C)[C@H](O)C[C@H]1OAglycone:
CC(O)CCCCC(=O)NCc1ccco1Sugarmoiety:
CC1OC(OC2CC(OC3OC(C)C(O)CC3O)C(O)OC2C)C(O)CC1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 13 |
| MolWt: | 615.72 | Num_heavy_atoms: | 43 |
| TPSA: | 178.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD01272
Formula: C12H19O3N
Smiles:
CC(O)CCCCC(=O)NCc1ccco1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 7 |
| MolWt: | 225.29 | Num_heavy_atoms: | 16 |
| TPSA: | 62.47 | NumAromaticRings: | 1 |
