Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012844
PROPERTIES
| NPAID | NPA012844 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Largamide F |
| FORMULA | C59H80BrN9O18 |
| MOLECULAR WEIGHT (Da) | 1283.2380 |
| ACCURATE MASS (Da) | 1281.4805 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Oscillatoria |
| ORIGIN SPECIES | sp. |
| InChIKey | MZYZCUCXNWCJKE-XBFYRACCSA-N |
| InChI | InChI=1S/C59H80BrN9O18/c1-28(2)46(65-50(77)30(5)61-51(78)39(62-54(81)44(75)27-70)11-9-10-33-12-17-36(72)18-13-33)55(82)67-48-32(7)87-59(86)47(29(3)4)66-53(80)42(26-35-16-22-43(74)38(60)24-35)68(8)58(85)49(31(6)71)69-45(76)23-21-40(57(69)84)63-52(79)41(64-56(48)83)25-34-14-19-37(73)20-15-34/h12-20,22,24,28-32,39-42,44-49,70-76H,9-11,21,23,25-27H2,1-8H3,(H,61,78)(H,62,81)(H,63,79)(H,64,83)(H,65,77)(H,66,80)(H,67,82)/t30-,31-,32+,39-,40-,41-,42-,44+,45+,46-,47-,48-,49-/m0/s1 |
| SMILES | C[C@@H]1[C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O1)C(C)C)CC3=CC(=C(C=C3)O)Br)C)[C@H](C)O)O)CC4=CC=C(C=C4)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCC5=CC=C(C=C5)O)NC(=O)[C@@H](CO)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 |
