Glycoside
GD015929
Name:
NoneFormula:
C45H86O14N4Smiles:
CCCCCCCCCCCCCC(=O)NCC(NC(=O)CCCCCCCCCCCCC)C(=O)NCCNC(=O)C(O)C(O)C(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C(O)COAglycone:
CCCCCCCCCCCCCC(=O)NCC(NC(=O)CCCCCCCCCCCCC)C(=O)NCC[NH]Sugarmoiety:
O=CC(O)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)COOther Identifiers
Properties
| HBA: | 18 | RingCount: | 1 |
| HBD: | 12 | FractionCSP3: | 0.91 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 39 |
| MolWt: | 907.2 | Num_heavy_atoms: | 63 |
| TPSA: | 296.7 | NumAromaticRings: | 0 |
Unique Aglycone
AD11522
Formula: C33H65O3N4
Smiles:
CCCCCCCCCCCCCC(=O)NCC(NC(=O)CCCCCCCCCCCCC)C(=O)NCC[NH]| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.91 |
| AlogP: | 7.39 | Num_rotatable_bonds: | 30 |
| MolWt: | 565.91 | Num_heavy_atoms: | 40 |
| TPSA: | 111.1 | NumAromaticRings: | 0 |
