Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000805
PROPERTIES
NPAID | NPA000805 |
---|---|
CLUSTER ID | 171 |
NODE ID | 160 |
NAME | Fomlactone A |
FORMULA | C33H50O5 |
MOLECULAR WEIGHT (Da) | 526.7580 |
ACCURATE MASS (Da) | 526.3658 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Fomes |
ORIGIN SPECIES | cajanderi |
InChIKey | SGSMRLJTYJLFMA-FPOLEOGZSA-N |
InChI | InChI=1S/C33H50O5/c1-18-17-33(20(3)19(2)28(35)38-33)37-27-16-24-23(31(8)15-12-22(18)32(27,31)9)10-11-25-29(5,6)26(36-21(4)34)13-14-30(24,25)7/h18-20,22,25-27H,10-17H2,1-9H3/t18-,19+,20+,22-,25+,26-,27-,30-,31+,32+,33+/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)OC(=O)C)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 |