Glycoside
GD022898
Name:
NoneFormula:
C46H87O10N3Smiles:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)N[C@H](COC1OC(C)C(O)C(O)C1O)C(=O)N[C@H](CCC(=O)OC)C(=O)NCAglycone:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NC(CO)C(=O)NC(CCC(=O)OC)C(=O)NCSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | 7.3 | Num_rotatable_bonds: | 37 |
| MolWt: | 842.21 | Num_heavy_atoms: | 59 |
| TPSA: | 192.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD15467
Formula: C40H77O6N3
Smiles:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NC(CO)C(=O)NC(CCC(=O)OC)C(=O)NC| HBA: | 9 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 8.45 | Num_rotatable_bonds: | 35 |
| MolWt: | 696.07 | Num_heavy_atoms: | 49 |
| TPSA: | 133.83 | NumAromaticRings: | 0 |
