Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028787
PROPERTIES
| NPAID | NPA028787 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyanopeptolin 1025 |
| FORMULA | C51H79N9O13 |
| MOLECULAR WEIGHT (Da) | 1026.2430 |
| ACCURATE MASS (Da) | 1025.5797 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown |
| ORIGIN SPECIES | sp. |
| InChIKey | VCGBQJUGWVTYEK-UHFFFAOYSA-N |
| InChI | InChI=1S/C51H79N9O13/c1-11-41(62)59-22-12-13-37(59)46(66)53-33(18-20-40(52)61)44(64)57-43-30(8)73-51(71)36(24-28(4)5)56-47(67)38(26-31-14-16-32(72-10)17-15-31)58(9)50(70)39(25-29(6)7)60-42(63)21-19-34(49(60)69)54-45(65)35(23-27(2)3)55-48(43)68/h14-17,27-30,33-39,42-43,63H,11-13,18-26H2,1-10H3,(H2,52,61)(H,53,66)(H,54,65)(H,55,68)(H,56,67)(H,57,64) |
| SMILES | CCC(=O)N1CCCC1C(=O)NC(CCC(N)=O)C(=O)NC1C(=O)NC(CC(C)C)C(=O)NC2CCC(O)N(C2=O)C(CC(C)C)C(=O)N(C)C(CC2=CC=C(OC)C=C2)C(=O)NC(CC(C)C)C(=O)OC1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sanz M; Andreote AP; Fiore MF; Dörr FA; Pinto E Structural Characterization of New Peptide Variants Produced by Cyanobacteria from the Brazilian Atlantic Coastal Forest Using Liquid Chromatography Coupled to Quadrupole Time-of-Flight Tandem Mass Spectrometry. Marine Drugs 2015 13 (6) 3892-3919. | ||
|---|---|---|---|
| DOI | 10.3390/md13063892 | PMID | 26096276 |
