Glycoside
GD154060
Name:
2-[(2-{1,5',11a,13a-tetramethyl-octadecahydro-1H-spiro[chryseno[2,1-b]furan-2,2'-oxan]-10-oloxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C40H66O14Smiles:
CC1CCC2(OC1)OC1CCC3C4CCC5CC(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(O)CC5(C)C4CCC3(C)C1C2CAglycone:
CC1CCC2(OC1)OC1CCC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C1C2CSugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 8 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 6 |
| MolWt: | 770.95 | Num_heavy_atoms: | 54 |
| TPSA: | 217.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD61228
Formula: C28H46O4
Smiles:
CC1CCC2(OC1)OC1CCC3C4CCC5CC(O)C(O)CC5(C)C4CCC3(C)C1C2C| HBA: | 4 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 5.15 | Num_rotatable_bonds: | 0 |
| MolWt: | 446.67 | Num_heavy_atoms: | 32 |
| TPSA: | 58.92 | NumAromaticRings: | 0 |
