Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018459
PROPERTIES
| NPAID | NPA018459 |
|---|---|
| CLUSTER ID | 679 |
| NODE ID | 601 |
| NAME | Largamide C |
| FORMULA | C47H63N7O13 |
| MOLECULAR WEIGHT (Da) | 934.0570 |
| ACCURATE MASS (Da) | 933.4484 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Oscillatoria |
| ORIGIN SPECIES | sp. |
| InChIKey | ROTNPXNPAMNTOL-VCEFGQNISA-N |
| InChI | InChI=1S/C47H63N7O13/c1-8-33-42(61)50-34(21-22-38(58)59)43(62)51-35(12-10-9-11-29-13-17-31(55)18-14-29)47(66)67-28(7)40(46(65)48-27(6)41(60)49-33)54-44(63)36(24-30-15-19-32(56)20-16-30)52-45(64)39(26(4)5)53-37(57)23-25(2)3/h8,13-20,23,26-28,34-36,39-40,55-56H,9-12,21-22,24H2,1-7H3,(H,48,65)(H,49,60)(H,50,61)(H,51,62)(H,52,64)(H,53,57)(H,54,63)(H,58,59)/b33-8-/t27-,28+,34+,35-,36-,39-,40-/m0/s1 |
| SMILES | C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)C=C(C)C)C)CCCCC3=CC=C(C=C3)O)CCC(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Plaza, Alberto; Bewley, Carole A. Largamides A-H, Unusual Cyclic Peptides from the Marine Cyanobacterium Oscillatoria sp Journal of Organic Chemistry 2006 71 (18) 6898-6907. | ||
|---|---|---|---|
| DOI | 10.1021/jo061044e | PMID | 16930043 |
