Glycoside
GD002894
Name:
3-{3a,6,6,9a-tetramethyl-dodecahydro-1H-cyclopenta[a]naphthalen-2-yl}-2,3,4-trihydroxybutyl acetateFormula:
C23H40O5Smiles:
CC(=O)OCC(O)C(O)(CO)[C@@H]1C[C@@H]2[C@](C)(CC[C@@H]3C(C)(C)CCC[C@]32C)C1Aglycone:
CC1(C)CCCC2(C)C1CCC1(C)CCCC12Sugarmoiety:
CC(=O)OCC(O)C(O)(O)COOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.96 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 396.57 | Num_heavy_atoms: | 28 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD02702
Formula: C17H30
Smiles:
CC1(C)CCCC2(C)C1CCC1(C)CCCC12| HBA: | 0 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 5.42 | Num_rotatable_bonds: | 0 |
| MolWt: | 234.43 | Num_heavy_atoms: | 17 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
