Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005055
PROPERTIES
| NPAID | NPA005055 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Trichovirin II 6b |
| FORMULA | C82H144N20O21 |
| MOLECULAR WEIGHT (Da) | 1746.1730 |
| ACCURATE MASS (Da) | 1745.0815 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | viride NRRL 5243 |
| InChIKey | VPLQVLFBQHCOHF-UHFFFAOYSA-N |
| InChI | InChI=1S/C82H144N20O21/c1-27-80(24,99-64(113)53(39-45(8)9)89-60(109)47(12)87-57(107)40-85-67(116)75(14,15)94-48(13)104)71(120)92-51(33-35-56(84)106)62(111)98-81(25,28-2)72(121)93-59(46(10)11)66(115)97-76(16,17)68(117)86-41-58(108)95-82(26,29-3)73(122)101-79(22,23)74(123)102-36-30-31-54(102)65(114)90-52(38-44(6)7)63(112)96-78(20,21)70(119)100-77(18,19)69(118)91-50(32-34-55(83)105)61(110)88-49(42-103)37-43(4)5/h43-47,49-54,59,103H,27-42H2,1-26H3,(H2,83,105)(H2,84,106)(H,85,116)(H,86,117)(H,87,107)(H,88,110)(H,89,109)(H,90,114)(H,91,118)(H,92,120)(H,93,121)(H,94,104)(H,95,108)(H,96,112)(H,97,115)(H,98,111)(H,99,113)(H,100,119)(H,101,122) |
| SMILES | CCC(C)(NC(=O)CNC(=O)C(C)(C)NC(=O)C(NC(=O)C(C)(CC)NC(=O)C(CCC(N)=O)NC(=O)C(C)(CC)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)CNC(=O)C(C)(C)NC(C)=O)C(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 |
