Details of Nilgherron B
| IUPAC | [(3S,5S,8R,16S,22R,24S)-10,22-dihydroxy-12,19-bis(2-hydroxypropan-2-yl)-4,4,8,25,25-pentamethyl-11-oxo-2,17-dioxaheptacyclo[16.13.0.03,8.03,16.09,14.021,31.024,29]hentriaconta-1(31),9,12,14,18,20,28-heptaen-5-yl] acetate |
| Canonical Smiles | CC(=O)O[C@H]1CC[C@@]2(C3=C(C(=O)C(=CC3=C[C@H]4[C@]2(C1(C)C)OC5=C6CC7=CCCC([C@@H]7C[C@H](C6=CC(=C5O4)C(C)(C)O)O)(C)C)C(C)(C)O)O)C |
| Inchi | ZVJVFNSFORQHNU-SXRPZUBGSA-N |
| PubChem ID | 101599983 |
| Smiles | CC(=O)O[C@H]1CC[C@]2(C)c3c(cc(C(C)(C)O)c(O)c3O)C=C3Oc4c(C(C)(C)O)cc5c(c4O[C@@]32C1(C)C)CC1=CCCC(C)(C)[C@@H]1C[C@H]5O |
| Class | Not available |
| Super Class | Sesquiterpenoids |
| Pathways | Terpenoids |
