Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577517 | Gold | 3 |
COMPOUND NPA005533
PROPERTIES
| NPAID | NPA005533 |
|---|---|
| CLUSTER ID | 2704 |
| NODE ID | 2092 |
| NAME | Trichogin A IV |
| FORMULA | C52H95N11O12 |
| MOLECULAR WEIGHT (Da) | 1066.3970 |
| ACCURATE MASS (Da) | 1065.7162 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | longibrachiatum |
| InChIKey | LZAAXJCEERCDPT-CKFFZNTQSA-N |
| InChI | InChI=1S/C52H95N11O12/c1-16-18-19-20-21-22-38(65)61-50(10,11)47(73)55-28-41(68)59-37(25-33(7)8)45(71)62-51(12,13)48(74)54-26-39(66)53-27-40(67)58-36(24-32(5)6)44(70)63-52(14,15)49(75)56-29-42(69)60-43(34(9)17-2)46(72)57-35(30-64)23-31(3)4/h31-37,43,64H,16-30H2,1-15H3,(H,53,66)(H,54,74)(H,55,73)(H,56,75)(H,57,72)(H,58,67)(H,59,68)(H,60,69)(H,61,65)(H,62,71)(H,63,70)/t34-,35-,36-,37-,43-/m0/s1 |
| SMILES | CCCCCCCC(=O)NC(C)(C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)CO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Auvin-Guette, Catherine; Rebuffat, Sylvie; Prigent, Yann; Bodo, Bernard Trichogin A IV, an 11-residue lipopeptaibol from trichoderma longibrachiatum Journal of the American Chemical Society 1992 114 (6) 2170-2174. | ||
|---|---|---|---|
| DOI | 10.1021/ja00032a035 | PMID | - |
