| SpectraBase Spectrum ID |
6RaKxWySWwr |
| Name |
Spermidine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
124-20-9 |
| ChEBI ID |
16610 |
| Comments |
100 mM spermidine - vendor: Sigma s2626; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C7 H19 N3 |
| IUPAC Name |
N-(3-aminopropyl)butane-1,4-diamine |
| InChI |
InChI=1S/C7H19N3/c8-4-1-2-6-10-7-3-5-9/h10H,1-9H2 |
| InChIKey |
ATHGHQPFGPMSJY-UHFFFAOYSA-N |
| KEGG Compound ID |
C00315 |
| KEGG Pathways |
PATH: map00220 Urea cycle and metabolism of amino groups
PATH: map00410 beta-Alanine metabolism
PATH: map02010 ABC transporters û General |
| PubChem Compound ID |
1102 |
| SMILES |
C(CCNCCCN)CN |
| Source File Reference |
bmse000116 |
