Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA003848
PROPERTIES
| NPAID | NPA003848 |
|---|---|
| CLUSTER ID | 867 |
| NODE ID | 141 |
| NAME | Minutissamide B |
| FORMULA | C51H82ClN13O15 |
| MOLECULAR WEIGHT (Da) | 1152.7460 |
| ACCURATE MASS (Da) | 1151.5742 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Anabaena |
| ORIGIN SPECIES | minutissima |
| InChIKey | BVPWTFZHTABZAH-IXKBYUEASA-N |
| InChI | InChI=1S/C51H82ClN13O15/c1-9-29-43(72)59-31(22-35(53)67)45(74)56-27(6)42(71)63-40(28(7)66)51(80)64(8)34(24-37(55)69)50(79)65-21-17-19-33(65)47(76)62-39(26(5)18-15-13-11-12-14-16-20-52)41(70)49(78)61-38(25(3)4)48(77)58-30(10-2)44(73)60-32(23-36(54)68)46(75)57-29/h9-10,25-28,31-34,38-41,66,70H,11-24H2,1-8H3,(H2,53,67)(H2,54,68)(H2,55,69)(H,56,74)(H,57,75)(H,58,77)(H,59,72)(H,60,73)(H,61,78)(H,62,76)(H,63,71)/b29-9+,30-10+/t26-,27+,28+,31-,32-,33-,34-,38-,39+,40-,41+/m0/s1 |
| SMILES | C/C=C/1\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)N[C@@H]([C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N1)CC(=O)N)C(C)C)O)[C@@H](C)CCCCCCCCCl)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N |
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 |
