Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010001
PROPERTIES
NPAID | NPA010001 |
---|---|
CLUSTER ID | 1796 |
NODE ID | 1458 |
NAME | Reveromycin I |
FORMULA | C37H52O11 |
MOLECULAR WEIGHT (Da) | 672.8120 |
ACCURATE MASS (Da) | 672.3510 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | RQOOSBSXFRTYCN-HHFXENKDSA-N |
InChI | InChI=1S/C37H52O11/c1-6-7-8-20-36(48-35(45)18-17-33(41)42)22-23-37(47-31(36)15-11-26(3)24-34(43)44)21-19-28(5)30(46-37)14-10-25(2)9-13-29(38)27(4)12-16-32(39)40/h9-13,15-18,24,27-31,38H,6-8,14,19-23H2,1-5H3,(H,39,40)(H,41,42)(H,43,44)/b13-9+,15-11+,16-12+,18-17+,25-10+,26-24+/t27-,28-,29-,30+,31-,36+,37-/m0/s1 |
SMILES | CCCCC[C@]1(CC[C@]2(CC[C@@H]([C@H](O2)C/C=C(\C)/C=C/[C@@H]([C@@H](C)/C=C/C(=O)O)O)C)O[C@H]1/C=C/C(=C/C(=O)O)/C)OC(=O)/C=C/C(=O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Fremlin, Leith; Farrugia, Michelle; Piggott, Andrew M; Khalil, Zeinab; Lacey, Ernest; Capon, Robert J Reveromycins revealed: new polyketide spiroketals from Australian marine-derived and terrestrial Streptomyces spp. A case of natural products vs. artifacts Organic & Biomolecular Chemistry 2011 9 (4) 1201-1211. | ||
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DOI | 10.1039/c0ob00654h | PMID | 21152660 |