Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA012771
PROPERTIES
NPAID | NPA012771 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | 14-acetoxy-22,23-dihydro-15,23-dihydroxyirpexan |
FORMULA | C38H68O11 |
MOLECULAR WEIGHT (Da) | 700.9510 |
ACCURATE MASS (Da) | 700.4762 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Irpex |
ORIGIN SPECIES | sp. 93028 |
InChIKey | AQZJZMMXWUPXJT-DOLYVOIWSA-N |
InChI | InChI=1S/C38H68O11/c1-25(2)14-10-15-26(3)17-12-23-38(9,46)31(49-35-34(43)33(42)32(41)29(24-39)48-35)20-19-30(47-28(5)40)37(8,45)22-13-18-27(4)16-11-21-36(6,7)44/h14,17-18,29-35,39,41-46H,10-13,15-16,19-24H2,1-9H3/b26-17+,27-18+/t29-,30?,31?,32-,33+,34+,35+,37?,38?/m1/s1 |
SMILES | CC(=CCC/C(=C/CCC(C)(C(CCC(C(C)(CC/C=C(\C)/CCCC(C)(C)O)O)OC(=O)C)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)/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 |