Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027359
PROPERTIES
| NPAID | NPA027359 |
|---|---|
| CLUSTER ID | 352 |
| NODE ID | 317 |
| NAME | Companeramide A |
| FORMULA | C57H97N9O11 |
| MOLECULAR WEIGHT (Da) | 1084.4550 |
| ACCURATE MASS (Da) | 1083.7308 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Leptolyngbya |
| ORIGIN SPECIES | sp. |
| InChIKey | HAFPBIZSTAZDFL-RTUBNDGLSA-N |
| InChI | InChI=1S/C57H97N9O11/c1-21-24-25-27-40-37(14)57(76)77-47(34(10)11)56(75)62(17)39(16)48(67)60-43(35(12)22-2)54(73)65(20)46(33(8)9)51(70)61-44(36(13)23-3)55(74)66-29-26-28-41(66)53(72)63(18)42(30-31(4)5)49(68)58-38(15)52(71)64(19)45(32(6)7)50(69)59-40/h1,31-47H,22-30H2,2-20H3,(H,58,68)(H,59,69)(H,60,67)(H,61,70)/t35-,36-,37+,38+,39-,40-,41+,42+,43+,44+,45+,46+,47+/m1/s1 |
| SMILES | C#CCCC[C@H]1NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H]([C@H](C)CC)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H]([C@H](C)CC)NC(=O)[C@@H](C)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@H]1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Vining OB; Medina RA; Mitchell EA; Videau P; Li D; Serrill JD; Kelly JX; Gerwick WH; Proteau PJ; Ishmael JE; McPhail KL Depsipeptide companeramides from a Panamanian marine cyanobacterium associated with the coibamide producer. Journal of Natural Products 2015 78 (3) 413-420. | ||
|---|---|---|---|
| DOI | 10.1021/np5007907 | PMID | 25562664 |
