Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014198
PROPERTIES
| NPAID | NPA014198 |
|---|---|
| CLUSTER ID | 1374 |
| NODE ID | 1156 |
| NAME | (7S,11S)-(+)-12-acetoxysydonic acid |
| FORMULA | C17H24O6 |
| MOLECULAR WEIGHT (Da) | 324.3730 |
| ACCURATE MASS (Da) | 324.1573 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | expansum 091006 |
| InChIKey | XJSUDGJMDALOTG-GTNSWQLSSA-N |
| InChI | InChI=1S/C17H24O6/c1-11(10-23-12(2)18)5-4-8-17(3,22)14-7-6-13(16(20)21)9-15(14)19/h6-7,9,11,19,22H,4-5,8,10H2,1-3H3,(H,20,21)/t11-,17-/m0/s1 |
| SMILES | C[C@@H](CCC[C@@](C)(C1=C(C=C(C=C1)C(=O)O)O)O)COC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lu, Zhenyu; Zhu, Huajie; Fu, Peng; Wang, Yi; Zhang, Zhihua; Lin, Haipeng; Liu, Peipei; Zhuang, Yibin; Hong, Kui; Zhu, Weiming Cytotoxic polyphenols from the marine-derived fungus penicillium expansum Journal of Natural Products 2010 73 (5) 911-914. | ||
|---|---|---|---|
| DOI | 10.1021/np100059m | PMID | 20415462 |
