Glycoside
GD026993
Name:
NoneFormula:
C43H67O12NSmiles:
CO[C@H](CCC=CCCCCC(=O)CCCCCCC(=O)CCC=CCCCCCCO[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)C(=O)NCCc1ccc(O)cc1Aglycone:
COC(CCC=CCCCCC(=O)CCCCCCC(=O)CCC=CCCCCCCO)C(=O)NCCc1ccc(O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | 5.64 | Num_rotatable_bonds: | 32 |
| MolWt: | 790.0 | Num_heavy_atoms: | 56 |
| TPSA: | 209.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD17768
Formula: C37H59O6N
Smiles:
COC(CCC=CCCCCC(=O)CCCCCCC(=O)CCC=CCCCCCCO)C(=O)NCCc1ccc(O)cc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.65 |
| AlogP: | 7.72 | Num_rotatable_bonds: | 29 |
| MolWt: | 613.88 | Num_heavy_atoms: | 44 |
| TPSA: | 112.93 | NumAromaticRings: | 1 |
