Glycoside
GD155968
Name:
(25s)-26-(beta-d-glucopyranosyloxy)-3-oxo-5alpha-furost-20(22)-en-6alpha-+Formula:
C38H60O13Smiles:
CC1=C(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CC(OC5OCC(O)C(O)C5O)C5CC(=O)CCC5(C)C4CCC3(C)C12Aglycone:
CC1=C(CCC(C)CO)OC2CC3C4CC(O)C5CC(=O)CCC5(C)C4CCC3(C)C12Sugarmoiety:
OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 9 |
| MolWt: | 724.88 | Num_heavy_atoms: | 51 |
| TPSA: | 204.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD61805
Formula: C27H42O4
Smiles:
CC1=C(CCC(C)CO)OC2CC3C4CC(O)C5CC(=O)CCC5(C)C4CCC3(C)C12| HBA: | 4 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.89 |
| AlogP: | 4.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 430.63 | Num_heavy_atoms: | 31 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
