Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001815
PROPERTIES
| NPAID | NPA001815 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Trichocellin-A-III |
| FORMULA | C89H147N23O24 |
| MOLECULAR WEIGHT (Da) | 1923.2920 |
| ACCURATE MASS (Da) | 1922.0989 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | viride |
| InChIKey | MCGQQMPEIPQXHC-UHFFFAOYSA-N |
| InChI | InChI=1S/C89H147N23O24/c1-27-46(4)62(102-77(133)85(17,18)107-68(124)55(37-40-59(92)117)98-63(119)47(5)94-74(130)83(13,14)105-65(121)49(7)96-75(131)84(15,16)106-64(120)48(6)95-73(129)82(11,12)103-50(8)114)71(127)109-81(9,10)72(128)93-43-60(118)104-87(21,22)78(134)111-89(25,26)80(136)112-41-31-34-56(112)69(125)101-61(45(2)3)70(126)108-88(23,24)79(135)110-86(19,20)76(132)100-54(36-39-58(91)116)67(123)99-53(35-38-57(90)115)66(122)97-52(44-113)42-51-32-29-28-30-33-51/h28-30,32-33,45-49,52-56,61-62,113H,27,31,34-44H2,1-26H3,(H2,90,115)(H2,91,116)(H2,92,117)(H,93,128)(H,94,130)(H,95,129)(H,96,131)(H,97,122)(H,98,119)(H,99,123)(H,100,132)(H,101,125)(H,102,133)(H,103,114)(H,104,118)(H,105,121)(H,106,120)(H,107,124)(H,108,126)(H,109,127)(H,110,135)(H,111,134) |
| SMILES | CCC(C)C(C(=O)NC(C)(C)C(=O)NCC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)NC(CC2=CC=CC=C2)CO)NC(=O)C(C)(C)NC(=O)C(CCC(=O)N)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wada, Shun-ichi; Nishimura, Tetsuya; Iida, Akira; Toyama, Nobuo; Fujita, Tetsuro Primary structures of antibiotic peptides, trichocellins-A and -B from Trichoderma viride Tetrahedron Letters 1994 35 (19) 3095-3098. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(00)76838-9 | PMID | - |
