C20 sphingosine (CHEBI:71982)

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CHEBI:71982 - C₂₀ sphingosine

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ChEBI ID	CHEBI:71982
ChEBI Name	C₂₀ sphingosine
Stars
ASCII Name	C20 sphingosine
Definition	A sphingoid that is the C₂₀ analogue of sphingosine.
Last Modified	21 July 2015
Submitter	Alan Bridge
Downloads	Molfile

Formula	C20H41NO2
Net Charge	0
Average Mass	327.553
Monoisotopic Mass	327.31373
SMILES	CCCCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO
InChI	InChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)19(21)18-22/h16-17,19-20,22-23H,2-15,18,21H2,1H3/b17-16+/t19-,20+/m0/s1
InChIKey	HTJSZHKGNMXZJN-YIVRLKKSSA-N

Species of Metabolite	Component	Source	Comments
Mus musculus (ncbitaxon:10090)	-	MetaboLights (MTBLS143)

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

ChEBI Ontology

Outgoing Relation(s)
	C₂₀ sphingosine (CHEBI:71982) has role mouse metabolite (CHEBI:75771)
	C₂₀ sphingosine (CHEBI:71982) is a aminodiol (CHEBI:22501)
	C₂₀ sphingosine (CHEBI:71982) is a sphingoid (CHEBI:35785)
	C₂₀ sphingosine (CHEBI:71982) is conjugate base of C₂₀ sphingosine(1+) (CHEBI:71983)
Incoming Relation(s)
	N-acylicosasphingosine-1-phosphocholine (CHEBI:82901) has functional parent C₂₀ sphingosine (CHEBI:71982)
	C₂₀ ceramide (CHEBI:71986) has functional parent C₂₀ sphingosine (CHEBI:71982)
	β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-N-acylicosasphingosine (CHEBI:82989) has functional parent C₂₀ sphingosine (CHEBI:71982)
	β-D-glucosyl-(1↔1')-N-acylicosasphingosine (CHEBI:82988) has functional parent C₂₀ sphingosine (CHEBI:71982)
	C₂₀ sphingosine(1+) (CHEBI:71983) is conjugate acid of C₂₀ sphingosine (CHEBI:71982)

IUPAC Name
(2S,3R,4E)-2-aminoicos-4-ene-1,3-diol

Synonyms	Source
eicosasphing-4-enine	SUBMITTER
C₂₀ sphing-4-enine	ChEBI
eicosasphingosine	ChEBI
icosasphing-4-enine	ChEBI
icosasphingosine	ChEBI
(2S,3R,4E)-2-aminoeicos-4-ene-1,3-diol	ChEBI

Registry Numbers	Sources
Reaxys:3547228	Reaxys

Citations