Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010682
PROPERTIES
| NPAID | NPA010682 |
|---|---|
| CLUSTER ID | 653 |
| NODE ID | 579 |
| NAME | Nosokomycin A |
| FORMULA | C64H103N4O33P |
| MOLECULAR WEIGHT (Da) | 1487.4970 |
| ACCURATE MASS (Da) | 1486.6242 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. K04-0144 |
| InChIKey | AFBSECGAINOYAH-OQDLKAIYSA-N |
| InChI | InChI=1S/C64H103N4O33P/c1-28(2)15-14-17-29(3)18-19-31(5)20-23-63(9,10)22-13-12-16-30(4)21-24-89-37(55(81)82)27-91-102(87,88)101-61-51(52(100-62(66)85)64(11,86)53(99-61)54(65)80)98-58-39(68-34(8)71)42(74)49(36(94-58)26-90-59-46(78)43(75)40(72)35(25-69)93-59)96-57-38(67-33(7)70)41(73)48(32(6)92-57)95-60-47(79)44(76)45(77)50(97-60)56(83)84/h12-13,15,18,21,32,35-53,57-61,69,72-79,86H,5,14,16-17,19-20,22-27H2,1-4,6-11H3,(H2,65,80)(H2,66,85)(H,67,70)(H,68,71)(H,81,82)(H,83,84)(H,87,88)/b13-12+,29-18+,30-21-/t32-,35-,36-,37-,38-,39-,40-,41-,42-,43+,44+,45+,46-,47-,48-,49-,50+,51-,52-,53-,57+,58+,59-,60-,61-,64+/m1/s1 |
| SMILES | C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)O[C@@H]3[C@H]([C@]([C@H](O[C@@H]3OP(=O)(O)OC[C@H](C(=O)O)OC/C=C(/C)\C/C=C/CC(C)(C)CCC(=C)C/C=C(\C)/CCC=C(C)C)C(=O)N)(C)O)OC(=O)N)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)NC(=O)C)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Uchida, Ryuji; Iwatsuki, Masato; Kim, Yong-Pil; Ohte, Satoshi; Mura, Satoshi; Tomoda, Hiroshi Nosokomycins, new antibiotics discovered in an in vivo-mimic infection model using silkworm larvae. I: Fermentation, isolation and biological properties Journal of Antibiotics 2010 63 (4) 151-155. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2010.9 | PMID | 20186168 |
