Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011680
PROPERTIES
| NPAID | NPA011680 |
|---|---|
| CLUSTER ID | 1239 |
| NODE ID | 1050 |
| NAME | Ansamitocinoside P-2 |
| FORMULA | C36H49ClN2O14 |
| MOLECULAR WEIGHT (Da) | 769.2410 |
| ACCURATE MASS (Da) | 768.2872 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinosynnema |
| ORIGIN SPECIES | pretiosum |
| InChIKey | BTDUKKIERMMEAH-BKTHIDDHSA-N |
| InChI | InChI=1S/C36H49ClN2O14/c1-7-27(42)52-25-14-26(41)39(33-31(45)30(44)29(43)23(16-40)50-33)20-12-19(13-21(48-5)28(20)37)11-17(2)9-8-10-24(49-6)36(47)15-22(51-34(46)38-36)18(3)32-35(25,4)53-32/h8-10,12-13,18,22-25,29-33,40,43-45,47H,7,11,14-16H2,1-6H3,(H,38,46)/b10-8-,17-9-/t18-,22+,23?,24-,25+,29?,30?,31?,32+,33?,35+,36+/m1/s1 |
| SMILES | CCC(=O)O[C@H]1CC(=O)N(C2=C(C(=CC(=C2)C/C(=C\C=C/[C@H]([C@]3(C[C@@H]([C@H]([C@H]4[C@]1(O4)C)C)OC(=O)N3)O)OC)/C)OC)Cl)C5C(C(C(C(O5)CO)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lu, Chunhua; Bai, Linquan; Shen, Yuemao A novel amide N-glycoside of ansamitocins from Actinosynnema pretiosum Journal of Antibiotics 2004 57 (5) 348-350. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.57.348 | PMID | 15303496 |
