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N-(9Z-octadecenoyl)-sphinganine

PropertiesImage
MNX_IDMNXM46086 Image of MNXM46086
referencechebi:74100
formulaC36H71NO3
global charge0
mol weight565.968
InChIKeyMJQIARGPQMNBGT-WWUCIAQXSA-N
InChIInChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,34-35,38-39H,3-16,19-33H2,1-2H3,(H,37,40)/b18-17-/t34-,35+/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,34-35,38-39H,3-16,19-33H2,1-2H3,(H,37,40)/b18-17-/t34-,35+/m0/s1 Image of MNXM46086
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:18]\[CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:36](=[N:37][C@@H:34]([CH2:33][OH:38])[C@@H:35]([CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:39])[OH:40]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:74100
chebi:74100
MJQIARGPQMNBGT-WWUCIAQXSA-N
N-(9Z-octadecenoyl)-sphinganine
(9Z)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]octadec-9-enamide
C18:1DH Cer
Cer(d18:0/18:1(9Z))
N-(9Z-octadecenoyl)dihydroceramide
N-(oleoyl)dihydroceramide
N-C18:1 sphinganine
N-[(9Z)-octadecenoyl]dihydrosphingosine
N-[(9Z)-octadecenoyl]sphinganine
N-oleoyldihydrosphingosine
N-oleoylsphinganine
hmdb:HMDB0011763
MJQIARGPQMNBGT-WWUCIAQXSA-N
Cer(d18:0/18:1(9Z))
(9Z)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]octadec-9-enamide
C18:1DH Cer
C18:1DH cer
Cer(D18:0/18:1(9Z))
Ceramide
Ceramide(D18:0/18:1(9Z))
N-(9Z-Octadecenoyl)-D-erythro-sphinganine
N-(9Z-Octadecenoyl)-dihydrosphingosine
N-(9Z-Octadecenoyl)-sphinganine
N-(9Z-Octadecenoyl)dihydroceramide
N-(Oleoyl)dihydroceramide
N-C18:1 Sphinganine
N-Oleoyldihydrosphingosine
N-Oleoylsphinganine
N-[(9Z)-Octadecenoyl]dihydrosphingosine

lipidmaps:LMSP02020015
lipidmapsM:LMSP02020015
MJQIARGPQMNBGT-WWUCIAQXSA-N
Cer(d18:0/18:1(9Z))
C18:1DH Cer
Cer 36:1
Cer[NdS]
N-(9Z-octadecenoyl)-dihydroceramide
N-(9Z-octadecenoyl)-sphinganine
N-(oleoyl)-dihydroceramide
O2

SLM:000000599
slm:000000599
MJQIARGPQMNBGT-WWUCIAQXSA-N
N-(9Z-octadecenoyl)-sphinganine
Cer(d18:0/18:1(9Z))
Ceramide (d18:0/18:1(9Z))

hmdb:HMDB11763
secondary/obsolete/fantasy identifier