Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007078
PROPERTIES
| NPAID | NPA007078 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Trichocellin-B-II |
| FORMULA | C90H148N22O25 |
| MOLECULAR WEIGHT (Da) | 1938.3030 |
| ACCURATE MASS (Da) | 1937.0986 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | viride |
| InChIKey | VYVVURSBDADAMA-UHFFFAOYSA-N |
| InChI | InChI=1S/C90H148N22O25/c1-27-90(26,80(136)100-55(37-40-62(118)119)68(124)99-54(35-38-59(91)115)67(123)97-53(45-113)43-52-32-29-28-30-33-52)111-79(135)88(22,23)109-72(128)63(47(4)5)102-71(127)58-34-31-41-112(58)81(137)89(24,25)110-78(134)87(20,21)104-61(117)44-93-73(129)82(10,11)108-70(126)57(42-46(2)3)101-77(133)86(18,19)107-69(125)56(36-39-60(92)116)98-64(120)48(6)94-75(131)84(14,15)105-66(122)50(8)96-76(132)85(16,17)106-65(121)49(7)95-74(130)83(12,13)103-51(9)114/h28-30,32-33,46-50,53-58,63,113H,27,31,34-45H2,1-26H3,(H2,91,115)(H2,92,116)(H,93,129)(H,94,131)(H,95,130)(H,96,132)(H,97,123)(H,98,120)(H,99,124)(H,100,136)(H,101,133)(H,102,127)(H,103,114)(H,104,117)(H,105,122)(H,106,121)(H,107,125)(H,108,126)(H,109,128)(H,110,134)(H,111,135)(H,118,119) |
| SMILES | CCC(C)(C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)N)C(=O)NC(CC1=CC=CC=C1)CO)NC(=O)C(C)(C)NC(=O)C(C(C)C)NC(=O)C2CCCN2C(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)CNC(=O)C(C)(C)NC(=O)C(CC(C)C)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 | - |
