Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019456
PROPERTIES
| NPAID | NPA019456 |
|---|---|
| CLUSTER ID | 144 |
| NODE ID | 137 |
| NAME | Aspereline H |
| FORMULA | C47H82N10O12 |
| MOLECULAR WEIGHT (Da) | 979.2310 |
| ACCURATE MASS (Da) | 978.6114 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | asperellum |
| InChIKey | KCNVGXNTEXQPAC-WCGFRGNPSA-N |
| InChI | InChI=1S/C47H82N10O12/c1-20-26(4)32(50-37(64)42(8,9)53-34(61)31(25(2)3)49-38(65)44(12,13)55-39(66)45(14,15)51-28(6)58)35(62)54-46(16,17)40(67)56-43(10,11)36(63)48-27(5)33(60)52-47(18,19)41(68)57-23-21-22-30(57)24-69-29(7)59/h25-27,30-32H,20-24H2,1-19H3,(H,48,63)(H,49,65)(H,50,64)(H,51,58)(H,52,60)(H,53,61)(H,54,62)(H,55,66)(H,56,67)/t26?,27-,30-,31-,32-/m0/s1 |
| SMILES | CCC(C)[C@@H](C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)NC(C)(C)C(=O)N1CCC[C@H]1COC(=O)C)NC(=O)C(C)(C)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Chen, Li; Zhong, Ping; Pan, Jian-Ru; Zhou, Kang-Jing; Huang, Kai; Fang, Zhe-Xiang; Zhang, Qi-Qing Asperelines G and H, two new peptaibols from the marine-derived fungus Trichoderma Asperellum Heterocycles 2013 87 (3) 645-655. | ||
|---|---|---|---|
| DOI | 10.3987/com-12-12644 | PMID | - |
