methyl rel-(9xi)-16-hydroxybeyeran-18-oate
Chemical Structure Depiction of
methyl rel-(9xi)-16-hydroxybeyeran-18-oate
methyl rel-(9xi)-16-hydroxybeyeran-18-oate
Compound characteristics
Compound ID: | N062-0011 |
Compound Name: | methyl rel-(9xi)-16-hydroxybeyeran-18-oate |
Molecular Weight: | 334.5 |
Molecular Formula: | C21 H34 O3 |
Smiles: | [H][C@]12CC[C@]34C[C@H]([C@@](C)(CCC4[C@]1(C)CCC[C@@]2(C)C(=O)OC)C3)O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.6559 |
logD: | 3.6559 |
logSw: | -4.114 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.348 |
InChI Key: | LYFJGTIFFFMUCR-INDCHSJVSA-N |