Glycoside
GD016218
Name:
NoneFormula:
C38H64O14N2Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@@H]3[C@H]2OC(=O)N3C)[C@@](C)(O)C[C@H](C)CN[C@H](C)[C@@H]2OC(=O)O[C@@]12CAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3C)C(C)(O)CC(C)CNC(C)C2OC(=O)OC12CSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 772.93 | Num_heavy_atoms: | 54 |
| TPSA: | 190.01 | NumAromaticRings: | 0 |
Unique Aglycone
AD11706
Formula: C30H50O11N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3C)C(C)(O)CC(C)CNC(C)C2OC(=O)OC12C| HBA: | 13 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 614.73 | Num_heavy_atoms: | 43 |
| TPSA: | 162.32 | NumAromaticRings: | 0 |