Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029017
PROPERTIES
| NPAID | NPA029017 |
|---|---|
| CLUSTER ID | 2019 |
| NODE ID | 1619 |
| NAME | RIF-1 |
| FORMULA | C32H65NO7S |
| MOLECULAR WEIGHT (Da) | 607.9390 |
| ACCURATE MASS (Da) | 607.4482 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Algoriphagus |
| ORIGIN SPECIES | machipongonensis |
| InChIKey | HUKGASICJQZLFQ-LTXXGDHTSA-N |
| InChI | InChI=1S/C32H65NO7S/c1-26(2)20-16-12-8-5-6-11-15-19-23-30(35)32(37)33-29(25-41(38,39)40)31(36)24-28(34)22-18-14-10-7-9-13-17-21-27(3)4/h26-31,34-36H,5-25H2,1-4H3,(H,33,37)(H,38,39,40)/t28-,29-,30+,31-/m1/s1 |
| SMILES | CC(C)CCCCCCCCCC[C@H](O)C(=O)N[C@H](CS(=O)(=O)O)[C@H](O)C[C@H](O)CCCCCCCCCC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Alegado RA; Brown LW; Cao S; Dermenjian RK; Zuzow R; Fairclough SR; Clardy J; King N A bacterial sulfonolipid triggers multicellular development in the closest living relatives of animals. eLife 2012 1 e00013. | ||
|---|---|---|---|
| DOI | 10.7554/eLife.00013 | PMID | 23066504 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | CC(C)CCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CS(=O)(=O)O)[C@H](O)C[C@H](O)CCCCCCCCCC(C)C | Alegado RA; Brown LW; Cao S; Dermenjian RK; Zuzow R; Fairclough SR; Clardy J; King N A bacterial sulfonolipid triggers multicellular development in the closest living relatives of animals. eLife 2012 1 e00013. DOI: 10.7554/eLife.00013 PMID: 23066504 | ||
| 2 | CC(C)CCCCCCCCCC[C@H](O)C(=O)N[C@H](CS(=O)(=O)O)[C@H](O)C[C@H](O)CCCCCCCCCC(C)C | Beemelmanns, Christine; Woznica, Arielle; Alegado, Rosanna A; Cantley, Alexandra M; King, Nicole; Clardy, Jon Synthesis of the rosette-inducing factor RIF-1 and analogs. Journal of the American Chemical Society 2014 136 (29) 10210-3. DOI: 10.1021/ja5046692 PMID: 24983513 | ||
