Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA014586
PROPERTIES
NPAID | NPA014586 |
---|---|
CLUSTER ID | 171 |
NODE ID | 160 |
NAME | Fomlactone B |
FORMULA | C31H48O4 |
MOLECULAR WEIGHT (Da) | 484.7210 |
ACCURATE MASS (Da) | 484.3553 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Fomes |
ORIGIN SPECIES | cajanderi |
InChIKey | LSGLUPXTGXDHCT-ZBAFWHTDSA-N |
InChI | InChI=1S/C31H48O4/c1-17-16-31(19(3)18(2)26(33)35-31)34-25-15-22-21(29(7)14-11-20(17)30(25,29)8)9-10-23-27(4,5)24(32)12-13-28(22,23)6/h17-20,23-25,32H,9-16H2,1-8H3/t17-,18+,19+,20-,23+,24-,25-,28-,29+,30+,31+/m1/s1 |
SMILES | C[C@@H]1C[C@]2([C@H]([C@@H](C(=O)O2)C)C)O[C@@H]3CC4=C(CC[C@@H]5[C@@]4(CC[C@H](C5(C)C)O)C)[C@]6([C@]3([C@@H]1CC6)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | He, Jian; Feng, Xiao-Zhang; Lu, Yang; Zhao, Bin Fomlactones A-C, novel triterpene lactones from Fomes cajanderi Journal of Natural Products 2003 66 (9) 1249-1251. | ||
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DOI | 10.1021/np0301994 | PMID | 14510609 |