Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024111
PROPERTIES
| NPAID | NPA024111 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Croissamide |
| FORMULA | C68H94N12O11 |
| MOLECULAR WEIGHT (Da) | 1255.5730 |
| ACCURATE MASS (Da) | 1254.7165 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Symploca |
| ORIGIN SPECIES | sp. |
| InChIKey | LUYWEMJRKVGFQI-AAEPAESSSA-N |
| InChI | InChI=1S/C68H94N12O11/c1-10-68(8,9)80-39-45(46-23-14-15-24-51(46)80)38-48-59(83)71-47(35-40(2)3)58(82)73-50(37-44-21-12-11-13-22-44)65(89)79-34-20-29-56(79)67(91)77-32-18-27-54(77)62(86)74-49(36-41(4)5)64(88)75-30-16-25-52(75)60(84)69-42(6)57(81)70-43(7)63(87)78-33-19-28-55(78)66(90)76-31-17-26-53(76)61(85)72-48/h10-15,21-24,39-43,47-50,52-56H,1,16-20,25-38H2,2-9H3,(H,69,84)(H,70,81)(H,71,83)(H,72,85)(H,73,82)(H,74,86)/t42-,43?,47-,48-,49-,50-,52-,53-,54-,55-,56-/m0/s1 |
| SMILES | C[C@H]1C(=O)NC(C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@H](C(=O)N6CCC[C@H]6C(=O)N1)CC(C)C)CC7=CC=CC=C7)CC(C)C)CC8=CN(C9=CC=CC=C98)C(C)(C)C=C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Iwasaki, Keitaro; Iwasaki, Arihiro; Sumimoto, Shimpei; Sano, Takuya; Hitomi, Yuki; Ohno, Osamu; Suenaga, Kiyotake Croissamide, a proline-rich cyclic peptide with an N-prenylated tryptophan from a marine cyanobacterium Symploca sp. Tetrahedron Letters 2018 59 (42) 3806-3809. | ||
|---|---|---|---|
| DOI | 10.1016/j.tetlet.2018.09.016 | PMID | - |
