Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002324
PROPERTIES
| NPAID | NPA002324 |
|---|---|
| CLUSTER ID | 867 |
| NODE ID | 141 |
| NAME | Minutissamide A |
| FORMULA | C51H83N13O15 |
| MOLECULAR WEIGHT (Da) | 1118.3010 |
| ACCURATE MASS (Da) | 1117.6132 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Anabaena |
| ORIGIN SPECIES | minutissima |
| InChIKey | CDKFNTHBTCWURX-GCFIISOESA-N |
| InChI | InChI=1S/C51H83N13O15/c1-10-13-14-15-16-17-19-26(6)39-41(69)49(77)60-38(25(4)5)48(76)57-30(12-3)44(72)59-32(23-36(53)67)46(74)56-29(11-2)43(71)58-31(22-35(52)66)45(73)55-27(7)42(70)62-40(28(8)65)51(79)63(9)34(24-37(54)68)50(78)64-21-18-20-33(64)47(75)61-39/h11-12,25-28,31-34,38-41,65,69H,10,13-24H2,1-9H3,(H2,52,66)(H2,53,67)(H2,54,68)(H,55,73)(H,56,74)(H,57,76)(H,58,71)(H,59,72)(H,60,77)(H,61,75)(H,62,70)/b29-11+,30-12+/t26-,27+,28+,31-,32-,33-,34-,38-,39+,40-,41+/m0/s1 |
| SMILES | CCCCCCCC[C@H](C)[C@@H]1[C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N)CC(=O)N)C(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kang, Hahk-Soo; Krunic, Aleksej; Shen, Qi; Swanson, Steven M.; Orjala, Jimmy Minutissamides A-D, antiproliferative cyclic decapeptides from the cultured cyanobacterium Anabaena minutissima Journal of Natural Products 2011 74 (7) 1597-1605. | ||
|---|---|---|---|
| DOI | 10.1021/np2002226 | PMID | 21699148 |
