Glycoside
GD115984
Name:
NoneFormula:
C47H77O14NSmiles:
CC=CC1OC(OC)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(OC2CC(O)C(OC(=N)O)C(C)O2)C1CAglycone:
CC=CC1OC(OC)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1CSugarmoiety:
CC1OC(O)CC(O)C1OC(=N)OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.74 |
| AlogP: | 6.05 | Num_rotatable_bonds: | 12 |
| MolWt: | 880.13 | Num_heavy_atoms: | 62 |
| TPSA: | 215.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD45981
Formula: C40H66O10
Smiles:
CC=CC1OC(OC)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1C| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | 5.65 | Num_rotatable_bonds: | 9 |
| MolWt: | 706.96 | Num_heavy_atoms: | 50 |
| TPSA: | 144.14 | NumAromaticRings: | 0 |
