Glycoside
GD144047
Name:
Furostane-2,3,22,26-Tetrol; (2α,3β,5α,22ζ,25R)-Form, 3-O-[α-L-Rhamnopyranosyl-(1->2)[α-L-Rhamnopyranosyl-(1->4)]-β-D-Glucopyranoside], 26-O-β-D-GlucopyranosideFormula:
C51H86O23Smiles:
CC(CCC1(O)OC2CC3C4CCC5CC(OC6OC(CO)C(OC7OC(C)C(O)C(O)C7O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1OAglycone:
CC(CO)CCC1(O)OC2CC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C2C1CSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 9 |
| HBD: | 14 | FractionCSP3: | 1.0 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 14 |
| MolWt: | 1067.23 | Num_heavy_atoms: | 74 |
| TPSA: | 366.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD06801
Formula: C27H46O5
Smiles:
CC(CO)CCC1(O)OC2CC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C2C1C| HBA: | 5 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 3.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.66 | Num_heavy_atoms: | 32 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
