Glycoside
GD130109
Name:
(3R,2'S)-Myxol 2'-FucosideFormula:
C46H68O7Smiles:
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)CC(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)CC(O)CC1(C)CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | 8.76 | Num_rotatable_bonds: | 16 |
| MolWt: | 733.04 | Num_heavy_atoms: | 53 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD52715
Formula: C40H58O3
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)CC(O)CC1(C)C| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 9.91 | Num_rotatable_bonds: | 14 |
| MolWt: | 586.9 | Num_heavy_atoms: | 43 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
