Glycoside
GD156781
Name:
(18R )-18-O-A-L-Rhamnopyranosyl-(1-6)-B-D-Glucopyranosideof Murolic AcidFormula:
C33H56O14Smiles:
C=C1C(=O)OC(CCCCCCCCCCCCCC(C)OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)C1C(=O)OAglycone:
C=C1C(=O)OC(CCCCCCCCCCCCCC(C)O)C1C(=O)OSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.88 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 20 |
| MolWt: | 676.8 | Num_heavy_atoms: | 47 |
| TPSA: | 221.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD45041
Formula: C21H36O5
Smiles:
C=C1C(=O)OC(CCCCCCCCCCCCCC(C)O)C1C(=O)O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.81 |
| AlogP: | 4.62 | Num_rotatable_bonds: | 15 |
| MolWt: | 368.51 | Num_heavy_atoms: | 26 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
