Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016356
PROPERTIES
NPAID | NPA016356 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Officimalonic acid F |
FORMULA | C35H52O8 |
MOLECULAR WEIGHT (Da) | 600.7930 |
ACCURATE MASS (Da) | 600.3662 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Fomes |
ORIGIN SPECIES | officinalis |
InChIKey | SVNICXKSXGSPGN-READASPFSA-N |
InChI | InChI=1S/C35H52O8/c1-19(21(3)31(40)41)10-11-20(2)22-12-15-34(7)30-23(16-26(37)35(22,34)8)33(6)14-13-27(43-29(39)18-28(38)42-9)32(4,5)25(33)17-24(30)36/h20-22,25-27,37H,1,10-18H2,2-9H3,(H,40,41)/t20-,21+,22-,25+,26-,27-,33-,34+,35+/m1/s1 |
SMILES | C[C@H](CCC(=C)[C@H](C)C(=O)O)[C@H]1CC[C@@]2([C@@]1([C@@H](CC3=C2C(=O)C[C@@H]4[C@@]3(CC[C@H](C4(C)C)OC(=O)CC(=O)OC)C)O)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Han, Jianxin; Li, Liya; Zhong, Jialiang; Tohtaton, Zeynep; Ren, Qing; Han, Li; Huang, Xueshi; Yuan, Tao Officimalonic acids A-H, lanostane triterpenes from the fruiting bodies of Fomes officinalis Phytochemistry 2016 130 193-200. | ||
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DOI | 10.1016/j.phytochem.2016.05.004 | PMID | 27216472 |