Glycoside
GD147103
Name:
GracilariosideFormula:
C49H93O10NSmiles:
CCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CC=CCCCCC1CC1CCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CC=CCCCCC1CC1CCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.94 |
| AlogP: | 9.15 | Num_rotatable_bonds: | 40 |
| MolWt: | 856.28 | Num_heavy_atoms: | 60 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD58921
Formula: C43H83O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CC=CCCCCC1CC1CCCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 11.32 | Num_rotatable_bonds: | 37 |
| MolWt: | 694.14 | Num_heavy_atoms: | 49 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
