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3-oxosphinganine

Properties

Image

Occurences in reactions

MNX_ID

MNXM559

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	5

formula

C₁₈H₃₈NO₂

charge

mass

300.49986

reference

chebi:58299

InChIKey

KBUNOSOGGAARKZ-KRWDZBQOSA-O

InChI

InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17,20H,2-16,19H2,1H3/p+1/t17-/m0/s1

SMILES

CCCCCCCCCCCCCCCC(=O)[C@@H]([NH3+])CO

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58299 chebi:58299	3-oxosphinganine (2S)-1-hydroxy-3-oxooctadecan-2-aminium 3-dehydrosphinganinium 3-dehydrosphinganinium cation 3-dehydrosphinganinium(1+)
bigg.metabolite:3dsphgn biggM:3dsphgn	3 Dehydrosphinganine
hmdb:HMDB0001480	3-Dehydrosphinganine (+-)-Isomer OF ketodihydrosphingosine (2S)-2-amino-1-Hydroxyoctadecan-3-one (2S)-2-amino-1-hydroxyoctadecan-3-one (S)-Isomer OF ketodihydrosphingosine 1-Hydroxy-2-amino-3-oxo-octadecane 2-amino-1-Hydroxy-3-octadecanone 3-Ketodihydrosphingosine 3-Ketosphinganine 3-dehydro-D-Sphinganine 3-ketosphinganine KDHS Ketodihydrosphingosine
kegg.compound:C02934 keggC:C02934	3-Dehydrosphinganine 3-Dehydro-D-sphinganine
seed.compound:cpd01879 seedM:cpd01879	3-Dehydrosphinganine 3-Dehydro-D-sphinganine 3-dehydro-D-sphinganine 3-dehydrosphinganine 3-dehydrosphinganine (C18) 3-ketodihydrosphingosine 3dsphgn KDHS
SLM:000000384 slm:000000384	3-dehydro-D-sphinganine
reactome:R-ALL-428182 reactomeM:R-ALL-428182 CHEBI:17862 chebi:17862	3-dehydrosphinganine (2S)-2-amino-1-hydroxyoctadecan-3-one 3-Dehydro-D-sphinganine 3-Dehydrosphinganine 3-dehydro-D-sphinganine 3-ketodihydrosphingosine 3-ketosphinganine
metacyc.compound:DEHYDROSPHINGANINE metacycM:DEHYDROSPHINGANINE	3-dehydrosphinganine 3-dehydro-D-sphinganine (C18) 3-dehydrosphinganine (C18) 3-ketodihydrosphingosine (C18) KDHS (C18)
hmdb:HMDB0062571	3-dehydrosphinganinium(1+) (2S)-1-hydroxy-3-oxooctadecan-2-aminium 3-Dehydrosphinganinium 3-Dehydrosphinganinium cation 3-Oxosphinganine 3-dehydro-D-sphinganine
lipidmaps:LMSP01020002 lipidmapsM:LMSP01020002	3-ketosphinganine 3-dehydrosphinganine
hmdb:HMDB01480 hmdb:HMDB62571 chebi:11776 chebi:11783 chebi:1489 chebi:19991 biggM:M_3dsphgn keggC:M_C02934 seedM:M_cpd01879	secondary/obsolete/fantasy identifier