Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA032213
PROPERTIES
| NPAID | NPA032213 |
|---|---|
| CLUSTER ID | 9378 |
| NODE ID | 6285 |
| NAME | Herpotrichone B |
| FORMULA | C22H26O7 |
| MOLECULAR WEIGHT (Da) | 402.4430 |
| ACCURATE MASS (Da) | 402.1679 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Herpotrichia |
| ORIGIN SPECIES | sp. SF09 |
| InChIKey | XMZRXROVLVZVQL-JOABLRHPSA-N |
| InChI | InChI=1S/C22H26O7/c1-5-6-11-18-14(25-3)9-17(23)28-15(18)7-12-10(2)27-21(26-4)13-8-16-19(29-16)20(24)22(11,12)13/h8-12,16,19,21H,5-7H2,1-4H3/t10-,11-,12-,16+,19+,21+,22+/m0/s1 |
| SMILES | CCC[C@H]1C2=C(C[C@H]3[C@H](C)O[C@@H](OC)C4=C[C@H]5O[C@H]5C(=O)[C@]413)OC(=O)C=C2OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Han, Wen-Bo; Wang, Guang-Yi; Tang, Jiang-Jiang; Wang, Wen-Ji; Liu, Han; Gil, Roberto R; Navarro-Vázquez, Armando; Lei, Xinxiang; Gao, Jin-Ming Herpotrichones A and B, Two Intermolecular [4 + 2] Adducts with Anti-Neuroinflammatory Activity from a Herpotrichia Species. Organic Letters 2020 22 (2) 405-409. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.9b04099 | PMID | 31874039 |
