(1S)-6-Amino-1,5-anhydro-2,3,6-trideoxy-1-{[5-(1-piperazinylmethyl)-1,2-oxazol-3-yl]methyl}-D-erythro-hexitol

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Systematic / IUPAC Name: (2R,3S,6S)-2-(Aminomethyl)-6-[[5-(piperazin-1-ylmethyl)-1,2-oxazol-3-yl]methyl]oxan-3-ol

ID: Reference12004

Other Names: D-Arabino-heptitol, 7-amino-2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(1-piperazinylmethyl)-3-isoxazolyl]-;
NAT12-541066

Formula: C15H26N4O3

Spectral Data

(1S)-6-Amino-1,5-anhydro-2,3,6-trideoxy-1-{[5-(1-piperazinylmethyl)-1,2-oxazol-3-yl]methyl}-D-erythro-hexitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 220
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 11/28/2022 4:54:26 PM
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Identificators

InChI InChI=1S/C15H26N4O3/c16-9-15-14(20)2-1-12(21-15)7-11-8-13(22-18-11)10-19-5-3-17-4-6-19/h8,12,14-15,17,20H,1-7,9-10,16H2/t12-,14-,15+/m0/s1
InChI Key IOVHJYIGIGEYPJ-AEGPPILISA-N
Canonical SMILES C1CC(C(OC1CC2=NOC(=C2)CN3CCNCC3)CN)O
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Other Names D-Arabino-heptitol, 7-amino-2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(1-piperazinylmethyl)-3-isoxazolyl]-;
NAT12-541066

In Other Databases

ChemSpider 29856782
PubChem 75536439