Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033130
PROPERTIES
| NPAID | NPA033130 |
|---|---|
| CLUSTER ID | 8784 |
| NODE ID | 141 |
| NAME | Cinnapeptin |
| FORMULA | C72H101N11O17 |
| MOLECULAR WEIGHT (Da) | 1392.6600 |
| ACCURATE MASS (Da) | 1391.7377 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | ghanaensis |
| InChIKey | MWADPICVQSLLSV-GSJUHUDTSA-N |
| InChI | InChI=1S/C72H101N11O17/c1-39(2)33-52-65(92)76-53(35-46-22-27-49(86)28-23-46)66(93)74-51(21-15-16-32-73)64(91)83-61(63(90)41(5)6)72(99)79-56(37-84)69(96)77-55(36-47-24-29-50(87)30-25-47)68(95)82-59(43(8)85)70(97)80-57(62(89)40(3)4)38-100-44(9)60(81-58(88)31-26-48-20-14-13-17-42(48)7)71(98)78-54(67(94)75-52)34-45-18-11-10-12-19-45/h10-14,17-20,22-31,39-41,43-44,51-57,59-63,84-87,89-90H,15-16,21,32-38,73H2,1-9H3,(H,74,93)(H,75,94)(H,76,92)(H,77,96)(H,78,98)(H,79,99)(H,80,97)(H,81,88)(H,82,95)(H,83,91)/b31-26+/t43-,44-,51-,52+,53-,54-,55+,56+,57-,59-,60-,61+,62?,63+/m1/s1 |
| SMILES | CC1=CC=CC=C1/C=C/C(=O)N[C@H]1C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC2=CC=C(O)C=C2)C(=O)N[C@H](CCCCN)C(=O)N[C@@H]([C@@H](O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC2=CC=C(O)C=C2)C(=O)N[C@H]([C@@H](C)O)C(=O)N[C@@H](C(O)C(C)C)CO[C@@H]1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Chen; Seyedsayamdost, Mohammad R. Discovery of a Cryptic Depsipeptide from Streptomyces ghanaensis via MALDI-MS-Guided High-Throughput Elicitor Screening Angewandte Chemie International Edition 2020 59 (51) 23005-23009. | ||
|---|---|---|---|
| DOI | 10.1002/anie.202009611 | PMID | 32790054 |
