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CHEBI:83021 - n-octyl sulfate
| Formula | C8H17O4S |
| Net Charge | -1 |
| Average Mass | 209.287 |
| Monoisotopic Mass | 209.08530 |
| SMILES | CCCCCCCCOS(=O)(=O)[O-] |
| InChI | InChI=1S/C8H18O4S/c1-2-3-4-5-6-7-8-12-13(9,10)11/h2-8H2,1H3,(H,9,10,11)/p-1 |
| InChIKey | UZZYXUGECOQHPU-UHFFFAOYSA-M |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Daphnia pulex (ncbitaxon:6669) | - | Article (Aliphatic sulfates released from Daphnia induce morphological defense of hytoplankton: isolation and synthesis of kairomonesKo Yasumoto, Akinori Nishigami, Mina Yasumoto, Fumie Kasai, Yasuhiro Okada, Takenori Kusumi and Takashi OoiaTetrahedron Letters 46 (2005) 4765-4767) | |
| Apostichopus japonicus (ncbitaxon:307972) | - | PubMed (22700234) |
| Roles Classification |
|---|
| Biological Roles: | Daphnia pulex metabolite A Daphnia metabolite produced by the species Daphnia pulex. marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms. kairomone A semiochemical used for inter-species chemical communication in a way that benefits an individual of another species that receives the chemical signal. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| n-octyl sulfate (CHEBI:83021) has role Daphnia pulex metabolite (CHEBI:83075) |
| n-octyl sulfate (CHEBI:83021) has role kairomone (CHEBI:83074) |
| n-octyl sulfate (CHEBI:83021) has role marine metabolite (CHEBI:76507) |
| n-octyl sulfate (CHEBI:83021) is a organosulfate oxoanion (CHEBI:58958) |
| n-octyl sulfate (CHEBI:83021) is conjugate base of octyl hydrogen sulfate (CHEBI:83122) |
| Incoming Relation(s) |
| octyl hydrogen sulfate (CHEBI:83122) is conjugate acid of n-octyl sulfate (CHEBI:83021) |
| IUPAC Name |
|---|
| octyl sulfate |
| UniProt Name | Source |
|---|---|
| octyl sulfate | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-21749 | MetaCyc |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1871742 | Reaxys |
| Citations |
|---|