Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010120
PROPERTIES
| NPAID | NPA010120 |
|---|---|
| CLUSTER ID | 514 |
| NODE ID | 460 |
| NAME | Trichoderin B |
| FORMULA | C59H108N10O12 |
| MOLECULAR WEIGHT (Da) | 1149.5710 |
| ACCURATE MASS (Da) | 1148.8148 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | sp. |
| InChIKey | KBWBVJMZIOXEBP-ULIOYMGRSA-N |
| InChI | InChI=1S/C59H108N10O12/c1-19-21-22-23-24-25-27-39(8)51(77)69-29-26-28-44(69)48(74)61-43(33-38(7)32-42(72)34-41(71)20-2)47(73)64-58(14,15)54(80)67-57(12,13)53(79)63-45(36(3)4)49(75)62-46(37(5)6)50(76)65-59(16,17)55(81)66-56(10,11)52(78)60-40(9)35-68(18)30-31-70/h36-40,42-46,70,72H,19-35H2,1-18H3,(H,60,78)(H,61,74)(H,62,75)(H,63,79)(H,64,73)(H,65,76)(H,66,81)(H,67,80)/t38-,39-,40+,42+,43+,44+,45+,46+/m1/s1 |
| SMILES | CCCCCCCC[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C[C@H](C)C[C@@H](CC(=O)CC)O)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](C)CN(C)CCO |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pruksakorn, Patamaporn; Arai, Masayoshi; Kotoku, Naoyuki; Vilchèze, Catherine; Baughn, Anthony D; Moodley, Prashini; Jacobs, William R; Kobayashi, Motomasa Trichoderins, novel aminolipopeptides from a marine sponge-derived Trichoderma sp., are active against dormant mycobacteria Bioorganic and Medicinal Chemistry Letters 2010 20 (12) 3658-3663. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmcl.2010.04.100 | PMID | 20483615 |
