Glycoside
GD156363
Name:
2-(9-{[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,5',11a,13a-tetramethyl-octadecahydro-1H-spiro[chryseno[2,1-b]furan-2,2'-oxane]oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C40H66O13Smiles:
CC1CCC2(OC1)OC1CCC3C4CC(OC5OC(CO)C(O)C(O)C5O)C5CC(OC6CC(O)C(O)C(CO)O6)CCC5(C)C4CCC3(C)C1C2CAglycone:
CC1CCC2(OC1)OC1CCC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C1C2CSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 8 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 754.95 | Num_heavy_atoms: | 53 |
| TPSA: | 196.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD61920
Formula: C28H46O4
Smiles:
CC1CCC2(OC1)OC1CCC3C4CC(O)C5CC(O)CCC5(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 |
