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N-octanoylsphing-4-enine

PropertiesImage
MNX_IDMNXM147181 Image of MNXM147181
referencechebi:45815
formulaC26H51NO3
global charge0
mol weight425.698
InChIKeyAPDLCSPGWPLYEQ-WRBRXSDHSA-N
InChIInChI=1S/C26H51NO3/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-21-25(29)24(23-28)27-26(30)22-20-17-8-6-4-2/h19,21,24-25,28-29H,3-18,20,22-23H2,1-2H3,(H,27,30)/b21-19+/t24-,25+/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCC
MNX internals
InChI (mnx)InChI=1/C26H51NO3/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-21-25(29)24(23-28)27-26(30)22-20-17-8-6-4-2/h19,21,24-25,28-29H,3-18,20,22-23H2,1-2H3,(H,27,30)/b21-19+/t24-,25+/m0/s1 Image of MNXM147181
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:18]/[CH:19]=[CH:21]/[C@H:25]([C@H:24]([CH2:23][OH:28])[N:27]=[C:26]([CH2:22][CH2:20][CH2:17][CH2:8][CH2:6][CH2:4][CH3:2])[OH:30])[OH:29]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:45815
chebi:45815
APDLCSPGWPLYEQ-WRBRXSDHSA-N 		N-octanoylsphing-4-enine
C8-ceramide
Cer(d18:1/8:0)
N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]octanamide
N-octanoylsphingosine

SLM:000395714
slm:000395714
APDLCSPGWPLYEQ-WRBRXSDHSA-N 		N-(octanoyl)-sphing-4-enine
Cer(d18:1(4E)/8:0)
Ceramide (d18:1(4E)/8:0)

sabiork.compound:27469
sabiorkM:27469
APDLCSPGWPLYEQ-WRBRXSDHSA-N 		N-Octanoyl-D-erythro-sphingosine

sabiork.compound:25150
sabiorkM:25150
APDLCSPGWPLYEQ-WRBRXSDHSA-N 		N-Octanoyl-D-sphingosine

CHEBI:183821
chebi:183821
APDLCSPGWPLYEQ-WRBRXSDHSA-N 		N-Octanoyl-D-sphingosine
8-deuterio-N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]octanamide