Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013750
PROPERTIES
| NPAID | NPA013750 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyclo(N-methyl-L-Phe-L-Val-D-Ile-L-Leu-L-Pro) |
| FORMULA | C32H49N5O5 |
| MOLECULAR WEIGHT (Da) | 583.7740 |
| ACCURATE MASS (Da) | 583.3734 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. |
| InChIKey | NSBVGLQWOAQURC-OLKMTBAESA-N |
| InChI | InChI=1S/C32H49N5O5/c1-8-21(6)27-30(40)33-23(17-19(2)3)31(41)37-16-12-15-24(37)32(42)36(7)25(18-22-13-10-9-11-14-22)28(38)34-26(20(4)5)29(39)35-27/h9-11,13-14,19-21,23-27H,8,12,15-18H2,1-7H3,(H,33,40)(H,34,38)(H,35,39)/t21?,23-,24-,25-,26-,27+/m0/s1 |
| SMILES | CCC(C)[C@@H]1C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N[C@H](C(=O)N1)C(C)C)CC3=CC=CC=C3)C)CC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wu, Wen; Dai, Huanqin; Bao, Li; Ren, Biao; Lu, Jingcai; Luo, Yuanming; Guo, Liangdong; Zhang, Lixin; Liu, Hongwei Isolation and structural elucidation of proline-containing cyclopentapeptides from an endolichenic Xylaria sp Journal of Natural Products 2011 74 (5) 1303-1308. | ||
|---|---|---|---|
| DOI | 10.1021/np100909y | PMID | 21428374 |
