Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024665
PROPERTIES
| NPAID | NPA024665 |
|---|---|
| CLUSTER ID | 2158 |
| NODE ID | 1370 |
| NAME | Micrococcin P2 |
| FORMULA | C48H47N13O9S6 |
| MOLECULAR WEIGHT (Da) | 1142.3880 |
| ACCURATE MASS (Da) | 1141.1944 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | pumilus |
| InChIKey | XLMXLFRJEYNHMO-RRXYFVOQSA-N |
| InChI | InChI=1S/C48H47N13O9S6/c1-8-24(37(65)49-12-20(5)62)51-38(66)28-15-73-46(56-28)32-18-74-45(58-32)26-11-10-23-36(50-26)27-13-75-48(53-27)35(22(7)64)61-41(69)31-17-76-47(57-31)33(19(3)4)59-39(67)30-16-72-44(55-30)25(9-2)52-42(70)34(21(6)63)60-40(68)29-14-71-43(23)54-29/h8-11,13-19,21-22,33-35,63-64H,12H2,1-7H3,(H,49,65)(H,51,66)(H,52,70)(H,59,67)(H,60,68)(H,61,69)/b24-8-,25-9-/t21-,22-,33+,34+,35+/m1/s1 |
| SMILES | C/C=C\1/C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C5=C(C=CC(=N5)C6=NC(=CS6)C7=NC(=CS7)C(=O)N/C(=C\C)/C(=O)NCC(=O)C)C8=NC(=CS8)C(=O)N[C@H](C(=O)N1)[C@@H](C)O)[C@@H](C)O)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Bycroft, BW; Gowland, MS The structures of the highly modified peptide antibiotics micrococcin P1 and P2 Journal of the Chemical Society, Chemical Communications 1978 1978 (6) 256-258. | ||
|---|---|---|---|
| DOI | 10.1039/C39780000256 | PMID | - |
