Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002525
PROPERTIES
| NPAID | NPA002525 |
|---|---|
| CLUSTER ID | 1490 |
| NODE ID | 1224 |
| NAME | Caryophyllan |
| FORMULA | C14H28O8 |
| MOLECULAR WEIGHT (Da) | 324.3700 |
| ACCURATE MASS (Da) | 324.1784 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Pseudomonas |
| ORIGIN SPECIES | caryophylli strain 2151 |
| InChIKey | DPJADXJMXJQMMX-RTIOCKPSSA-N |
| InChI | InChI=1S/C14H28O8/c1-7(15)12(18)10(20-3)5-11(17)14(19)6-9(16)13(21-4)22-8(14)2/h7-13,15-19H,5-6H2,1-4H3/t7-,8?,9?,10+,11+,12-,13?,14?/m1/s1 |
| SMILES | CC1C(CC(C(O1)OC)O)([C@H](C[C@@H]([C@@H]([C@@H](C)O)O)OC)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | De Castro, C; Lanzetta, R; Molinaro, A; Parrilli, M; Piscopo, V Acetyl substitution of the O-specific polysaccharide caryophyllan from the phenol phase of Pseudomonas (Burkholderia) caryophylli Carbohydrate Research 2001 335 (3) 205-211. | ||
|---|---|---|---|
| DOI | 10.1016/s0008-6215(01)00220-8 | PMID | 11578636 |
