Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015425
PROPERTIES
| NPAID | NPA015425 |
|---|---|
| CLUSTER ID | 2121 |
| NODE ID | 1694 |
| NAME | Sanglifehrin C |
| FORMULA | C61H93N5O13 |
| MOLECULAR WEIGHT (Da) | 1104.4370 |
| ACCURATE MASS (Da) | 1103.6770 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. A92-308110 |
| InChIKey | GYXRDKLWEUPOMU-UQIUYKCVSA-N |
| InChI | InChI=1S/C61H93N5O13/c1-12-43-31-38(6)61(64-55(43)71)41(9)53(70)40(8)51(78-61)34-49(69)36(4)21-15-13-16-22-37(5)50-27-18-14-17-26-48(68)39(7)54-45(28-29-60(10,76-11)79-54)56(72)63-52(35(2)3)57(73)62-47(33-42-23-19-24-44(67)32-42)58(74)66-30-20-25-46(65-66)59(75)77-50/h13-14,16-19,22-24,26,32,35-36,38-41,43,45-54,65,67-70H,12,15,20-21,25,27-31,33-34H2,1-11H3,(H,62,73)(H,63,72)(H,64,71)/b16-13+,18-14+,26-17+,37-22+/t36-,38-,39-,40-,41-,43-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54+,60-,61+/m0/s1 |
| SMILES | CC[C@H]1C[C@@H]([C@@]2([C@H]([C@H]([C@H]([C@@H](O2)C[C@@H]([C@@H](C)CC/C=C/C=C(\C)/[C@@H]3C/C=C/C=C/[C@@H]([C@@H]([C@@H]4[C@@H](CC[C@@](O4)(C)OC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N5CCC[C@H](N5)C(=O)O3)CC6=CC(=CC=C6)O)C(C)C)C)O)O)C)O)C)NC1=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Fehr, Theodor; Kallen, JOeRG; Oberer, Lukas; Sanglier, Jean-Jacques; Schilling, Wolfgang Sanglifehrins A, B, C and D, novel cyclophilin-binding compounds isolated from Streptomyces sp. A92-308110. II. Structure elucidation, stereochemistry and physico-chemical properties Journal of Antibiotics 1999 52 (5) 474-479. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.52.474 | PMID | 10480571 |
