Glycoside
GD123029
Name:
(3S,2′S)-4-Ketomyxol 2′-FucosideFormula:
C46H66O8Smiles:
CC(C=CC=C(C)C=CC=C(C)CCC(OC1OC(C)C(O)C(O)C1O)C(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)C(=O)C(O)CC1(C)CAglycone:
CC(C=CC=C(C)C=CC=C(C)CCC(O)C(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)C(=O)C(O)CC1(C)CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 7.94 | Num_rotatable_bonds: | 16 |
| MolWt: | 747.03 | Num_heavy_atoms: | 54 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD49625
Formula: C40H56O4
Smiles:
CC(C=CC=C(C)C=CC=C(C)CCC(O)C(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)C(=O)C(O)CC1(C)C| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 9.09 | Num_rotatable_bonds: | 14 |
| MolWt: | 600.88 | Num_heavy_atoms: | 44 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
