Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA009281
PROPERTIES
| NPAID | NPA009281 |
|---|---|
| CLUSTER ID | 679 |
| NODE ID | 601 |
| NAME | Tiglicamide B |
| FORMULA | C44H57N7O12 |
| MOLECULAR WEIGHT (Da) | 875.9770 |
| ACCURATE MASS (Da) | 875.4065 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | confervoides |
| InChIKey | HTQZRXGEFURKNL-RGQURIAKSA-N |
| InChI | InChI=1S/C44H57N7O12/c1-8-24(5)37(55)50-35(23(3)4)42(60)48-32(21-28-15-17-29(52)18-16-28)41(59)51-36-26(7)63-44(62)33(22-27-13-11-10-12-14-27)49-40(58)31(19-20-34(53)54)47-39(57)30(9-2)46-38(56)25(6)45-43(36)61/h8-18,23,25-26,31-33,35-36,52H,19-22H2,1-7H3,(H,45,61)(H,46,56)(H,47,57)(H,48,60)(H,49,58)(H,50,55)(H,51,59)(H,53,54)/b24-8+,30-9-/t25-,26+,31+,32+,33-,35-,36-/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)CC3=CC=CC=C3)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 |
