(10-Methyl-7-propan-2-yl-3-tricyclo[4.4.0.01,5]dec-3-enyl)methanol
PubChem CID: 46224401
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| Topological Polar Surface Area | 20.2 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 16.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 330.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (10-methyl-7-propan-2-yl-3-tricyclo[4.4.0.01,5]dec-3-enyl)methanol |
| Prediction Hob | 0.0 |
| Xlogp | 3.2 |
| Molecular Formula | C15H24O |
| Prediction Swissadme | 1.0 |
| Inchi Key | FETRHPNVBWGLFA-UHFFFAOYSA-N |
| Fcsp3 | 0.8666666666666667 |
| Logs | -3.718 |
| Rotatable Bond Count | 2.0 |
| Logd | 3.358 |
| Compound Name | (10-Methyl-7-propan-2-yl-3-tricyclo[4.4.0.01,5]dec-3-enyl)methanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 220.183 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 220.183 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 220.35 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.1028071999999995 |
| Inchi | InChI=1S/C15H24O/c1-9(2)12-5-4-10(3)15-7-11(8-16)6-13(15)14(12)15/h6,9-10,12-14,16H,4-5,7-8H2,1-3H3 |
| Smiles | CC1CCC(C2C13C2C=C(C3)CO)C(C)C |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Asarum Sieboldii (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Schisandra Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients