Glycoside
GD017932
Name:
NoneFormula:
C38H66O9N2Smiles:
CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@H](CCN2CCCCCCC2)C[C@H](C)C(=O)C=CC(C)=C[C@H]1COAglycone:
CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CCCCCCC2)CC(C)C(=O)C=CC(C)=CC1COSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.84 |
| AlogP: | 3.47 | Num_rotatable_bonds: | 8 |
| MolWt: | 694.95 | Num_heavy_atoms: | 49 |
| TPSA: | 149.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD01620
Formula: C30H51O6N
Smiles:
CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CCCCCCC2)CC(C)C(=O)C=CC(C)=CC1CO| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 4.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 521.74 | Num_heavy_atoms: | 37 |
| TPSA: | 107.3 | NumAromaticRings: | 0 |
