TPCN03036
![[object Object]](../../static/browser_molecular_png/TPCN03036.png)
| Name | Tetradecanoic acid, 12-methyl-, (1aR,1bS,4aR,7aS,7bR,8R,9aS)-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benz[1,2-e]azulen-9a-yl ester;1 |
| Molecular Formula | C35H56O6 |
| Molecular Weight | 572.83 |
| CAS Registry Number | 2373372-15-5 |
| SMILES | CCC(C)CCCCCCCCCCC(=O)OC12CC(C)C3(O)C(C=C(CO)CC4(O)C(=O)C(C)=CC43)C1C2(C)C |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Euphorbiaceae | Euphorbia fischeriana | Roots | 0.000096% | Nat Prod Res, 1-9 (2019). | 10.1080/14786419.2019.1607331 |
| Euphorbiaceae | Euphorbia fischeriana | Roots | 0.000096% | Natural Product Research, 34(21), 3027-3035. doi:10.1080/14786419.2019.1607331 | 10.1080/14786419.2019.1607331 |
Properties
| HBA | 6 | HBD | 3 |
| HeavyAtoms | 41 | AlogP | 6.46 |
| TPSA | 104.06 | RotatableBonds | 14 |
| FractionCSP3 | 0.83 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |