Glycoside
GD122301
Name:
5-[(3,4-dihydroxy-3-methyloxolan-2-yl)methyl]-1,4a-dimethyl-6-methylidene-decahydronaphthalene-1-carboxylic acidFormula:
C20H32O5Smiles:
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CC1OCC(O)C1(C)OAglycone:
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CSugarmoiety:
CC1(O)C(O)COC1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.85 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 352.47 | Num_heavy_atoms: | 25 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD49269
Formula: C15H24O2
Smiles:
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1C| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 3.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 236.35 | Num_heavy_atoms: | 17 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
