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IndAc34
General Description
| Name | Value |
|---|
| Level | S-3 / C-1 |
| Discovered | 2020 / H. curta & Hololena sp. |
| Synonym | — |
| Molecular formula | C₁₇H₂₆N₄O |
| CAS | — |
| SMILES | O=C(NCCCNCCCCN)CC1=CNC2=C1C=CC=C2 |
| InChI | InChI=1S/C17H26N4O/c18-8-3-4-9-19-10-5-11-20-17(22)12-14-13-21-16-7-2-1-6-15(14)16/h1-2,6-7,13,19,21H,3-5,8-12,18H2,(H,20,22) |
| |
| Precursor 1 [M+H]⁺ | 303.21794 |
| Precursor 2 [M+2H]²⁺ | 152.11261 |
| Precursor 3 | |
| |
| HDX | 5 |
| Precursor HDX [M(D₅)+D]⁺ | 309.25560 |
| Precursor HDX 2 [M(D₅)+2D]²⁺ | 155.63458 |
| Precursor HDX 3 | |
| |
| Rt | 8.62 |
| Rt HDX | 7.25 |
Calculated MS/MS fragments
| # | a | b | c | ta | z | y | tz |
|---|
| 1 | 215.11789 | 197.10732 | 198.09134 | 232.14444 | 72.08078 | 55.05423 | 89.10732 |
| 2 | 286.19139 | 268.18082 | 269.16484 | 303.21794 | 129.13862 | 112.11208 | 146.16517 |
Additional MS/MS fragments
| m/z | Annotation |
|---|
| 130.06513 | a’ |
| 158.06004 | a0 |
Recorded MS/MS spectra
| pdf | Precursor | Co-eluting | Spider | Source | Author |
|---|
| Data | 303.21794 | | H. curta | Fauna Laboratories Ltd., KAZ | Y. M. Forster |
| Data | HDX | | H. curta | Fauna Laboratories Ltd., KAZ | Y. M. Forster |
| Data | 303.21794 | | Hololena sp. | Spider Pharm, USA | Y. M. Forster |
| Data | HDX | | Hololena sp. | Spider Pharm, USA | Y. M. Forster |
References
| Title | Reference | Spider | Name | Content | Link |
|---|
| Low molecular mass compounds in spider venom | Y. M. Forster, S. Bienz, L. Bigler, 2020, in preparation | div. | | | Link |
Spider species
| Spider species | Family | Discovered |
|---|
| Hololena curta | Agelenidae | 2020 / Y. M. Forster |
| Hololena sp. | Agelenidae | 2020 / Y. M. Forster |