Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013642
PROPERTIES
| NPAID | NPA013642 |
|---|---|
| CLUSTER ID | 867 |
| NODE ID | 141 |
| NAME | Minutissamide C |
| FORMULA | C55H89N13O16 |
| MOLECULAR WEIGHT (Da) | 1188.3920 |
| ACCURATE MASS (Da) | 1187.6550 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Anabaena |
| ORIGIN SPECIES | minutissima |
| InChIKey | HZHLPFLQTJCCHS-HFAMINCGSA-N |
| InChI | InChI=1S/C55H89N13O16/c1-10-32(70)22-19-17-15-13-14-16-18-21-29(6)43-45(74)53(82)64-42(28(4)5)52(81)61-34(12-3)48(77)63-36(26-40(57)72)50(79)60-33(11-2)47(76)62-35(25-39(56)71)49(78)59-30(7)46(75)66-44(31(8)69)55(84)67(9)38(27-41(58)73)54(83)68-24-20-23-37(68)51(80)65-43/h11-12,28-31,35-38,42-45,69,74H,10,13-27H2,1-9H3,(H2,56,71)(H2,57,72)(H2,58,73)(H,59,78)(H,60,79)(H,61,81)(H,62,76)(H,63,77)(H,64,82)(H,65,80)(H,66,75)/b33-11+,34-12+/t29-,30+,31+,35-,36-,37-,38-,42-,43+,44-,45+/m0/s1 |
| SMILES | CCC(=O)CCCCCCCCC[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 |
