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sphing-4-enine

PropertiesImage
MNX_IDMNXM1364421 Image of MNXM1364421
referencechebi:57756
formulaC18H38NO2
global charge1
mol weight300.507
InChIKeyWWUZIQQURGPMPG-KRWOKUGFSA-O
InChIInChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/p+1/b15-14+/t17-,18+/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H]([NH3+])CO
MNX internals
InChI (mnx)InChI=1/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1 Image of MNXM1364421
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]/[C@H:18]([C@H:17]([CH2:16][OH:20])[NH2:19])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)57
in models (compartimentalized) 29
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-1132148
reactomeM:R-ALL-1132148
CHEBI:57756
chebi:57756
WWUZIQQURGPMPG-KRWOKUGFSA-O 		sphing-4-enine
(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-aminium
sphingosine(1+)

sabiork.compound:25670
sabiorkM:25670
WWUZIQQURGPMPG-KRWOKUGFSA-N 		D-Sphingosine

seed.compound:cpd00267
seedM:cpd00267
WWUZIQQURGPMPG-KRWOKUGFSA-O 		Sphingoid
(4E)-sphing-4-enine
2-amino-4-octadecene-1,3-diol
D-erythro-sphingosine
Sphing-4-enine
Sphingenine
Sphingosine
sphingenine
sphingosine
hmdb:HMDB0062807
WWUZIQQURGPMPG-KRWOKUGFSA-O 		Sphingosine(1+)
(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-aminium
Sphing-4-enine
sphingosine(1+)
hmdb:HMDB0000252
WWUZIQQURGPMPG-KRWOKUGFSA-N 		Sphingosine
(-)-D-erythro-Sphingosine
(-)-Sphingosine
(2S,3R)-(e)-2-Amino-1,3-dihydroxy-4-octadecene
(2S,3R)-Sphingosine
(2S,3R,4E)-2-Amino-3-hydroxyoctadec-4-ene-1-ol
(2S,3R,4E)-2-Amino-4-octadecene-1,3-diol
(2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol
(2S,3R,e)-2-Aminooctadec-4-ene-1,3-diol
(4E)-Sphing-4-enine
(4E)-Sphingenine
(e)-2-Amino-4-octadecan-1,3-diol
(e)-D-Erythro-4-octadecene-1,3-diol
2-Amino-4-octadecene-1,3-diol
4 Sphingenine
4-Sphingenine
4-trans-Sphingenine
C18 Sphingosine
C18-Sphingosine
D-(+)-Erythro-1,3-dihydroxy-2-amino-4-trans-octadecene
D-(+)-erythro-4-trans-Sphingenine
D-Erythro-sphingosine
D-Sphingosine
D-erythro-C18-Sphingosine
Erythrosphingosine
SP(d18:1)
Sph
Sphing-4-enine
Sphingenine
Sphingoid
Sphingosin
Sphingosine D18:1
erythro-4-Sphingenine
erythro-C18-Sphingosine
sphingosine
trans-4-Sphingenine
trans-D-Erythro-2-amino-4-octadecene-1,3-diol

lipidmaps:LMSP01010001
lipidmapsM:LMSP01010001
WWUZIQQURGPMPG-KRWOKUGFSA-N 		Sphingosine
(2S,3R,4E)-2-Amino-4-octadecene-1,3-diol
2S-Amino-4E-octadecene-1,3R-diol
4-Sphingenine
4-trans-Sphingenine
D-erythro-Sphingosine
O2
SPB 18:1
Sphing-4-enine
Sphingenine
Sphingosine

kegg.compound:C00319
keggC:C00319
WWUZIQQURGPMPG-KRWOKUGFSA-N 		Sphingosine
Sphing-4-enine
Sphingenine
Sphingoid

SLM:000000412
slm:000000412
WWUZIQQURGPMPG-KRWOKUGFSA-O 		sphing-4-enine

vmhM:sphings
vmhmetabolite:sphings
WWUZIQQURGPMPG-KRWOKUGFSA-O 		sphingosine(1+)
(2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol

CHEBI:16393
chebi:16393
WWUZIQQURGPMPG-KRWOKUGFSA-N 		sphingosine
(2S,3R)-(E)-2-amino-1,3-dihydroxy-4-octadecene
(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-ene-1-ol
(2S,3R,4E)-2-amino-4-octadecene-1,3-diol
(2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol
(2S,3R,E)-2-aminooctadec-4-ene-1,3-diol
(4E)-sphing-4-enine
(4E)-sphingenine
(E)-2-amino-4-octadecan-1,3-diol
(E)-D-erythro-4-octadecene-1,3-diol
2-amino-4-octadecene-1,3-diol
C18 sphingosine
D-(+)-erythro-1,3-dihydroxy-2-amino-4-trans-octadecene
D-erythro-sphingosine
Sph
Sphing-4-enine
Sphingenine
Sphingoid
Sphingosine
Sphingosine d18:1
sphingosin
trans-4-sphingenine
trans-D-erythro-2-amino-4-octadecene-1,3-diol

metacyc.compound:SPHINGOSINE
metacycM:SPHINGOSINE
WWUZIQQURGPMPG-KRWOKUGFSA-O 		sphingosine
(4E)-sphing-4-enine
2-amino-4-octadecene-1,3-diol
D-erythro-sphingosine
sphingenine

hmdb:HMDB00252
hmdb:HMDB62807
chebi:15102
chebi:207585
chebi:26741
chebi:9224
keggC:M_C00319
seedM:M_cpd00267
vmhM:M_sphings 		secondary/obsolete/fantasy identifier