Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004150
PROPERTIES
| NPAID | NPA004150 |
|---|---|
| CLUSTER ID | 920 |
| NODE ID | 141 |
| NAME | Glycinocin B |
| FORMULA | C58H92N12O19 |
| MOLECULAR WEIGHT (Da) | 1261.4390 |
| ACCURATE MASS (Da) | 1260.6602 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | NYKOFOHQRGHCFZ-ONHLGXEGSA-N |
| InChI | InChI=1S/C58H92N12O19/c1-6-34(4)49-58(89)70-25-19-22-41(70)54(85)59-29-39(66-53(84)38(28-48(80)81)63-42(72)23-16-14-12-10-8-7-9-11-13-15-20-33(2)3)57(88)69-24-18-17-21-40(69)55(86)62-31-44(74)65-36(26-46(76)77)51(82)60-30-43(73)64-37(27-47(78)79)52(83)61-32-45(75)67-50(35(5)71)56(87)68-49/h16,23,33-41,49-50,71H,6-15,17-22,24-32H2,1-5H3,(H,59,85)(H,60,82)(H,61,83)(H,62,86)(H,63,72)(H,64,73)(H,65,74)(H,66,84)(H,67,75)(H,68,87)(H,76,77)(H,78,79)(H,80,81)/b23-16+/t34?,35?,36-,37-,38-,39-,40?,41-,49-,50+/m0/s1 |
| SMILES | CCC(C)[C@H]1C(=O)N2CCC[C@H]2C(=O)NC[C@@H](C(=O)N3CCCCC3C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(=O)N1)C(C)O)CC(=O)O)CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)/C=C/CCCCCCCCCCC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | KONG, FANGMING; CARTER, GUY T. Structure Determination of Glycinocins A to D, Further Evidence for the Cyclic Structure of the Amphomycin Antibiotics Journal of Antibiotics 2003 56 (6) 557-564. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.56.557 | PMID | 12931866 |
