Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018258
PROPERTIES
NPAID | NPA018258 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | Irpexan |
FORMULA | C36H62O7 |
MOLECULAR WEIGHT (Da) | 606.8850 |
ACCURATE MASS (Da) | 606.4496 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Irpex |
ORIGIN SPECIES | sp. 93028 |
InChIKey | AAEDIAWSKYSEKJ-ULWXIDRDSA-N |
InChI | InChI=1S/C36H62O7/c1-25(2)14-9-16-27(5)18-11-19-28(6)20-12-22-31(43-35-34(40)33(39)32(38)30(24-37)42-35)36(8,41)23-13-21-29(7)17-10-15-26(3)4/h14-15,18,20-21,30-35,37-41H,9-13,16-17,19,22-24H2,1-8H3/b27-18+,28-20+,29-21+/t30-,31?,32-,33+,34+,35+,36?/m1/s1 |
SMILES | CC(=CCC/C(=C/CC/C(=C/CCC(C(C)(CC/C=C(\C)/CCC=C(C)C)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)/C)/C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Silberborth; Erkel; Anke; Sterner The Irpexans, a new group of biologically active metabolites produced by the basidiomycete Irpex sp. 93028 Journal of Antibiotics 2000 53 (10) 1137-1144. | ||
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DOI | 10.7164/antibiotics.53.1137 | PMID | 11132959 |