Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014467
PROPERTIES
| NPAID | NPA014467 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Trichokonin-Ib |
| FORMULA | C89H147N23O24 |
| MOLECULAR WEIGHT (Da) | 1923.2920 |
| ACCURATE MASS (Da) | 1922.0989 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | koningii |
| InChIKey | FATPXEYUKIVQRZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C89H147N23O24/c1-45(2)40-56(70(125)108-89(24,25)81(136)112-39-29-32-57(112)71(126)102-63(46(3)4)72(127)110-88(22,23)80(135)111-87(20,21)78(133)101-54(34-37-59(91)116)68(123)100-53(33-36-58(90)115)67(122)97-52(44-113)41-51-30-27-26-28-31-51)98-61(118)42-93-75(130)83(12,13)109-73(128)64(47(5)6)103-79(134)86(18,19)107-69(124)55(35-38-60(92)117)99-65(120)48(7)95-77(132)85(16,17)106-66(121)49(8)96-76(131)84(14,15)105-62(119)43-94-74(129)82(10,11)104-50(9)114/h26-28,30-31,45-49,52-57,63-64,113H,29,32-44H2,1-25H3,(H2,90,115)(H2,91,116)(H2,92,117)(H,93,130)(H,94,129)(H,95,132)(H,96,131)(H,97,122)(H,98,118)(H,99,120)(H,100,123)(H,101,133)(H,102,126)(H,103,134)(H,104,114)(H,105,119)(H,106,121)(H,107,124)(H,108,125)(H,109,128)(H,110,127)(H,111,135) |
| SMILES | CC(C)CC(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)CNC(=O)C(C)(C)NC(=O)C(C(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)CNC(=O)C(C)(C)NC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | HUANG, Qing; TEZUKA, Yasuhiro; HATANAKA, Yasumaru; KIKUCHI, Tohru; NISHI, Arasuke; TUBAKI, Keisuke Studies on Metabolites of Mycoparasitic Fungi. IV. Minor Peptaibols of Trichoderma koningii Chemical and Pharmaceutical Bulletin 1995 43 (10) 1663-1667. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.43.1663 | PMID | 8536339 |
