Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025525
PROPERTIES
| NPAID | NPA025525 |
|---|---|
| CLUSTER ID | 1213 |
| NODE ID | 1031 |
| NAME | Trivirensol C |
| FORMULA | C45H62O16 |
| MOLECULAR WEIGHT (Da) | 858.9750 |
| ACCURATE MASS (Da) | 858.4038 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | virens CMB-TN16 |
| InChIKey | OZSWIYLDENFVQM-ACQBYUCJSA-N |
| InChI | InChI=1S/C45H62O16/c1-22(2)28-7-12-45(56)21-61-42(53)36(45)31(28)13-25(16-46)38(49)59-19-43(54)11-9-30(24(5)6)33-15-27(18-58-41(52)35(33)43)39(50)60-20-44(55)10-8-29(23(3)4)32-14-26(37(47)48)17-57-40(51)34(32)44/h13-15,22-24,28-36,46,54-56H,7-12,16-21H2,1-6H3,(H,47,48)/b25-13+/t28-,29-,30-,31-,32-,33-,34-,35-,36-,43-,44-,45-/m1/s1 |
| SMILES | CC(C)[C@H]1CC[C@]([C@@H]2[C@@H]1C=C(COC2=O)C(=O)O)(COC(=O)C3=C[C@@H]4[C@H](CC[C@]([C@H]4C(=O)OC3)(COC(=O)/C(=C/[C@@H]5[C@H](CC[C@@]6([C@H]5C(=O)OC6)O)C(C)C)/CO)O)C(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jiao WH; Salim AA; Khalil ZG; Dewapriya P; Lin HW; Butler MS; Capon RJ Trivirensols: Selectively Bacteriostatic Sesquiterpene Trimers from the Australian Termite Nest-Derived Fungus Trichoderma virens CMB-TN16. Journal of Natural Products 2019 82 (11) 3165-3175. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.9b00760 | PMID | 31625738 |
