Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008382
PROPERTIES
| NPAID | NPA008382 |
|---|---|
| CLUSTER ID | 653 |
| NODE ID | 579 |
| NAME | Nosokomycin D |
| FORMULA | C58H94N5O27P |
| MOLECULAR WEIGHT (Da) | 1324.3720 |
| ACCURATE MASS (Da) | 1323.5874 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. K04-0144 |
| InChIKey | HAFIOCYTDXYWKI-WKIRDRJHSA-N |
| InChI | InChI=1S/C58H94N5O27P/c1-27(2)15-14-17-28(3)18-19-30(5)20-23-57(9,10)22-13-12-16-29(4)21-24-80-35(51(74)75)26-81-91(78,79)90-55-46(47(89-56(61)76)58(11,77)48(88-55)50(60)73)87-53-37(63-33(8)66)39(68)44(34(25-64)83-53)85-52-36(62-32(7)65)38(67)43(31(6)82-52)84-54-42(71)40(69)41(70)45(86-54)49(59)72/h12-13,15,18,21,31,34-48,52-55,64,67-71,77H,5,14,16-17,19-20,22-26H2,1-4,6-11H3,(H2,59,72)(H2,60,73)(H2,61,76)(H,62,65)(H,63,66)(H,74,75)(H,78,79)/b13-12+,28-18+,29-21-/t31-,34-,35-,36-,37-,38-,39-,40+,41+,42-,43-,44-,45+,46-,47-,48-,52+,53+,54-,55-,58+/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)NC(=O)C)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)N)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Uchida, Ryuji; Iwatsuki, Masato; Kim, Yong-Pil; Oemura, Satoshi; Tomoda, Hiroshi Nosokomycins, new antibiotics discovered in an in vivo-mimic infection model using silkworm larvae. II: Structure elucidation Journal of Antibiotics 2010 63 (4) 157-163. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2010.10 | PMID | 20203703 |
