Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014920
PROPERTIES
| NPAID | NPA014920 |
|---|---|
| CLUSTER ID | 4555 |
| NODE ID | 3331 |
| NAME | Phomanolide B |
| FORMULA | C24H32O6 |
| MOLECULAR WEIGHT (Da) | 416.5140 |
| ACCURATE MASS (Da) | 416.2199 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | sp. |
| InChIKey | FWDUNYAYYMYOQL-MBFUXWLISA-N |
| InChI | InChI=1S/C24H32O6/c1-15-7-10-21(2,3)8-6-9-22(4)16(11-17(15)25)13-24-18(28-22)12-19(26)29-23(24,5)14-20(27)30-24/h6-8,12,16-17,25H,9-11,13-14H2,1-5H3/b8-6+,15-7-/t16-,17+,22+,23-,24-/m1/s1 |
| SMILES | C/C/1=C/CC(/C=C/C[C@]2([C@H](C[C@@H]1O)C[C@@]34C(=CC(=O)O[C@@]3(CC(=O)O4)C)O2)C)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Jinyu; Liu, Ling; Wang, Bo; Zhang, Yang; Wang, Lili; Liu, Xingzhong; Che, Yongsheng Phomanolides A and B from the Fungus Phoma sp.: Meroterpenoids Derived from a Putative Tropolonic Sesquiterpene via Hetero-Diels-Alder Reactions Journal of Natural Products 2015 78 (12) 3058-3066. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.5b00969 | PMID | 26651221 |
