Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000969
PROPERTIES
| NPAID | NPA000969 |
|---|---|
| CLUSTER ID | 679 |
| NODE ID | 601 |
| NAME | Tiglicamide A |
| FORMULA | C45H59N7O13 |
| MOLECULAR WEIGHT (Da) | 906.0030 |
| ACCURATE MASS (Da) | 905.4171 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | confervoides |
| InChIKey | QBFLXQREXRVZCV-IAOICVMWSA-N |
| InChI | InChI=1S/C45H59N7O13/c1-8-24(5)38(57)51-36(23(3)4)43(62)50-34(22-28-12-17-30(54)18-13-28)42(61)52-37-26(7)65-45(64)33(19-14-27-10-15-29(53)16-11-27)49-41(60)32(20-21-35(55)56)48-40(59)31(9-2)47-39(58)25(6)46-44(37)63/h8-13,15-18,23,25-26,32-34,36-37,53-54H,14,19-22H2,1-7H3,(H,46,63)(H,47,58)(H,48,59)(H,49,60)(H,50,62)(H,51,57)(H,52,61)(H,55,56)/b24-8+,31-9-/t25-,26+,32+,33-,34+,36-,37-/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)CCC3=CC=C(C=C3)O)CCC(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Matthew, Susan; Paul, Valerie J.; Luesch, Hendrik Tiglicamides A-C, cyclodepsipeptides from the marine cyanobacterium Lyngbya confervoides Phytochemistry 2009 70 (17-18) 2058-2063. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2009.09.010 | PMID | 19815244 |
