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Phe334
General Description
| Name | Value |
|---|
| Level | S-3 / C-1 |
| Discovered | 2020 / H. curta & Hololena sp. |
| Synonym | — |
| Molecular formula | C₁₉H₃₅N₅O |
| CAS | — |
| SMILES | O=C(NCCCNCCCNCCCCN)C(N)CC1=CC=CC=C1 |
| InChI | InChI=1S/C19H35N5O/c20-10-4-5-11-22-12-6-13-23-14-7-15-24-19(25)18(21)16-17-8-2-1-3-9-17/h1-3,8-9,18,22-23H,4-7,10-16,20-21H2,(H,24,25) |
| |
| Precursor 1 [M+H]⁺ | 350.29144 |
| Precursor 2 [M+2H]²⁺ | 175.64936 |
| Precursor 3 | |
| |
| HDX | 7 |
| Precursor HDX 1 [M(D₇)+D]⁺ | 358.34165 |
| Precursor HDX 2 [M(D₇)+2D]²⁺ | 180.17760 |
| Precursor HDX 3 | |
| |
| Rt | 3.09 |
| Rt HDX | 2.46 |
Calculated MS/MS fragments
| # | a | b | c | ta | z | y | tz |
|---|
| 1 | 205.13354 | 187.12297 | 188.10699 | 222.16009 | 72.08078 | 55.05423 | 89.10732 |
| 2 | 262.19139 | 244.18082 | 245.16484 | 279.21794 | 129.13862 | 112.11208 | 146.16517 |
| 3 | 333.26489 | 315.25432 | 316.23834 | 350.29144 | 186.19647 | 169.16993 | 203.22302 |
Additional MS/MS fragments
Recorded MS/MS spectra
| pdf | Precursor | Co-eluting | Spider | Source | Author |
|---|
| Data | 350.29144 | Phe343 | H. curta | Fauna Laboratories Ltd., KAZ | Y. M. Forster |
| Data | HDX | Phe343 | H. curta | Fauna Laboratories Ltd., KAZ | Y. M. Forster |
| Data | 350.29144 | Phe343 | Hololena sp. | Spider Pharm, USA | Y. M. Forster |
| Data | HDX | Phe343 | 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 |