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PA3(OH)43

General Description

Name	Value
Level	S-3 / C-1
Discovered	2005 / A. aperta & H. curta
Synonym	—
Molecular formula	C₁₀H₂₆N₄O
CAS	864812-09-9
SMILES	`NCCCN(O)CCCCNCCCN`
InChI	`InChI=1S/C10H26N4O/c11-5-3-8-13-7-1-2-9-14(15)10-4-6-12/h13,15H,1-12H2`

Precursor 1 [M+H]⁺	219.21794
Precursor 2 [M+2H]²⁺	110.11261
Precursor 3

HDX	6
Precursor HDX 1 [M(D₆)+D]⁺	226.26188
Precursor HDX 2 [M(D₆)+2D]²⁺	114.13771
Precursor HDX 3

Rt	1.08
Rt HDX	1.00

Calculated MS/MS fragments

#	a	b	c	ta	z	y	tz
1	58.06513	40.05456	41.03858	91.08659	58.06513	41.03858	75.09167
2	145.13354	127.12297	128.10699	162.16009	129.13862	112.11208	162.16009
3	202.19139	184.18082	185.16484	219.21794	202.19139	185.16484	219.21794

Additional MS/MS fragments

m/z	Annotation

Recorded MS/MS spectra

pdf	Precursor	Co-eluting	Spider	Source	Author
Data	219.21794	PA3(OH)34	Hololena sp.	Spider Pharm, USA	Y. M. Forster
Data	HDX	PA3(OH)34	Hololena sp.	Spider Pharm, USA	Y. M. Forster

References

Title	Reference	Spider	Name	Content	Link
New linear polyamine derivatives in spider venoms	M. Tzouros, S. Chesnov, S. Bienz, M. Hesse, L. Bigler, Toxicon 2005, 46, 350-354	A. aperta & H. curta		APCI-MS/MS (ns)	Link
A template approach for the characterization of linear polyamines and derivatives in spider venom	Manuel Tzouros, Sergiy Chesnov, Laurent Bigler, Stefan Bienz, Eur. J. Mass Spectrom. 2013, 19, 57-69	A. aperta & H. curta		APCI-MS/MS (ns)	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
Agelenopsis aperta	Agelenidae	2005 / M. Tzouros
Hololena curta	Agelenidae	2005 / M. Tzouros
Hololena sp.	Agelenidae	2020 / Y. M. Forster

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