Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014795
PROPERTIES
| NPAID | NPA014795 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Trichovirin II 3b |
| FORMULA | C80H140N20O21 |
| MOLECULAR WEIGHT (Da) | 1718.1190 |
| ACCURATE MASS (Da) | 1717.0502 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | viride NRRL 5243 |
| InChIKey | QPSKNIUNCSZDMH-UHFFFAOYSA-N |
| InChI | InChI=1S/C80H140N20O21/c1-27-79(25,95-61(111)51(38-44(7)8)87-57(107)45(9)85-55(105)39-83-63(113)72(11,12)91-46(10)102)69(119)90-49(32-34-54(82)104)59(109)94-80(26,28-2)70(120)99-77(21,22)68(118)96-73(13,14)64(114)84-40-56(106)92-75(17,18)66(116)98-78(23,24)71(121)100-35-29-30-52(100)62(112)88-50(37-43(5)6)60(110)93-76(19,20)67(117)97-74(15,16)65(115)89-48(31-33-53(81)103)58(108)86-47(41-101)36-42(3)4/h42-45,47-52,101H,27-41H2,1-26H3,(H2,81,103)(H2,82,104)(H,83,113)(H,84,114)(H,85,105)(H,86,108)(H,87,107)(H,88,112)(H,89,115)(H,90,119)(H,91,102)(H,92,106)(H,93,110)(H,94,109)(H,95,111)(H,96,118)(H,97,117)(H,98,116)(H,99,120) |
| SMILES | CCC(C)(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)CNC(=O)C(C)(C)NC(C)=O)C(=O)NC(CCC(N)=O)C(=O)NC(C)(CC)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(CO)CC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jaworski, A; Kirschbaum, J; Brückner, H Structures of trichovirins II, peptaibol antibiotics from the mold Trichoderma viride NRRL 5243 Journal of Peptide Science 1999 5 (8) 341-351. | ||
|---|---|---|---|
| DOI | 10.1002/(sici)1099-1387(199908)5:8<341::aid-psc204>3.0.co;2-0 | PMID | 10507683 |
