Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA023811
PROPERTIES
| NPAID | NPA023811 |
|---|---|
| CLUSTER ID | 5669 |
| NODE ID | 4016 |
| NAME | Phomopsterone B |
| FORMULA | C29H42O3 |
| MOLECULAR WEIGHT (Da) | 438.6520 |
| ACCURATE MASS (Da) | 438.3134 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phomopsis |
| ORIGIN SPECIES | sp. TJ507A |
| InChIKey | BVMOANOTEXFTJU-TZBVVVHISA-N |
| InChI | InChI=1S/C29H42O3/c1-17(2)20(5)18(3)14-19(4)22-8-9-26(32)29-16-24(31)23-15-21(30)10-12-27(23,6)25(29)11-13-28(22,29)7/h14-15,17,19-20,22,25H,8-13,16H2,1-7H3/t19-,20-,22-,25-,27+,28-,29+/m1/s1 |
| SMILES | C[C@H](C=C(C)[C@H](C)C(C)C)[C@H]1CCC(=O)[C@@]23[C@@]1(CC[C@@H]2[C@]4(CCC(=O)C=C4C(=O)C3)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hu, Zhengxi; Wu, Ye; Xie, Shuangshuang; Sun, Weiguang; Guo, Yi; Li, Xiao-Nian; Liu, Junjun; Li, Hua; Wang, Jianping; Luo, Zengwei; Xue, Yongbo; Zhang, Yonghui Phomopsterones A and B, two functionalized ergostane-type steroids from the endophytic fungus phomopsis sp. TJ507A Organic Letters 2017 19 (1) 258-261. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.6b03557 | PMID | 28004944 |
