Platydiol
PubChem CID: 14431885
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| Compound Synonyms | Platydiol, DTXSID801318591, 70630-07-8 |
|---|---|
| Topological Polar Surface Area | 40.5 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 198.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (2R,6S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,6-diol |
| Prediction Hob | 1.0 |
| Xlogp | 1.4 |
| Molecular Formula | C10H18O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | UAENXMZBFMXPED-VZCHMASFSA-N |
| Fcsp3 | 1.0 |
| Logs | -1.608 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.591 |
| Compound Name | Platydiol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 170.131 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 170.131 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 170.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.7460624 |
| Inchi | InChI=1S/C10H18O2/c1-9(2)6-4-7(11)10(9,3)8(12)5-6/h6-8,11-12H,4-5H2,1-3H3/t6?,7-,8+,10? |
| Smiles | CC1(C2C[C@H](C1([C@H](C2)O)C)O)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Glaucium Oxylobum (Plant) Rel Props:Source_db:cmaup_ingredients