Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023796
PROPERTIES
| NPAID | NPA023796 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Phomopchalasin A |
| FORMULA | C28H37NO4 |
| MOLECULAR WEIGHT (Da) | 451.6070 |
| ACCURATE MASS (Da) | 451.2723 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phomopsis |
| ORIGIN SPECIES | sp. shj2 |
| InChIKey | JVLHNUNFFFDFDT-XIHPKKOBSA-N |
| InChI | InChI=1S/C28H37NO4/c1-14-10-15(2)12-21(30)22-19(11-14)26(32)28-23(16(3)17(4)25(31)24(22)28)20(29-27(28)33)13-18-8-6-5-7-9-18/h5-9,11,15-16,19-26,30-32H,4,10,12-13H2,1-3H3,(H,29,33)/t15-,16-,19+,20+,21-,22-,23+,24+,25-,26-,28-/m1/s1 |
| SMILES | C[C@H]1C[C@H]([C@H]2[C@H](C=C(C1)C)[C@H]([C@]34[C@@H]2[C@@H](C(=C)[C@H]([C@H]3[C@@H](NC4=O)CC5=CC=CC=C5)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yan, Bing-Chao; Wang, Wei-Guang; Hu, Dong-Bao; Sun, Xiang; Kong, Ling-Mei; Li, Xiao-Nian; Du, Xue; Luo, Shi-Hong; Liu, Yan; Li, Yan; Sun, Han-Dong; Pu, Jian-Xin Phomopchalasins A and B, Two Cytochalasans with Polycyclic-Fused Skeletons from the Endophytic Fungus Phomopsis sp. shj2 Organic Letters 2016 18 (5) 1108-1111. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.6b00214 | PMID | 26881701 |
