Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA025652
PROPERTIES
NPAID | NPA025652 |
---|---|
CLUSTER ID | 7749 |
NODE ID | 5286 |
NAME | Phosteoid A |
FORMULA | C21H32O5 |
MOLECULAR WEIGHT (Da) | 364.4820 |
ACCURATE MASS (Da) | 364.2250 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Phomopsis |
ORIGIN SPECIES | tersa FS441 |
InChIKey | CTPKIBJHXRLFDR-IJPHBKGRSA-N |
InChI | InChI=1S/C21H32O5/c1-11(19-18(25)12(2)20(3,4)26-19)14-6-7-15-13(10-17(23)24)16(22)8-9-21(14,15)5/h11-12,14,18-19,25H,6-10H2,1-5H3,(H,23,24)/t11-,12-,14+,18-,19+,21+/m0/s1 |
SMILES | C[C@H]([C@H]1OC(C)(C)[C@@H](C)[C@@H]1O)[C@H]1CCC2=C(CC(=O)O)C(=O)CC[C@@]21C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chen, Shanchong; Liu, Zhaoming; Chen, Yuchan; Tan, Haibo; Zhu, Shuang; Liu, Hongxin; Zhang, Weimin Phosteoid A, a highly oxygenated norsteroid from the deep-sea-derived fungus Phomopsis tersa FS441 Tetrahedron Letters 2019 None. | ||
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DOI | 10.1016/j.tetlet.2019.151555 | PMID | - |