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N-octanoylsphinganine

PropertiesImage
MNX_IDMNXM147208 Image of MNXM147208
referencechebi:82841
formulaC26H53NO3
global charge0
mol weight427.714
InChIKeyLGOFBZUQIUVJFS-LOSJGSFVSA-N
InChIInChI=1S/C26H53NO3/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/h24-25,28-29H,3-23H2,1-2H3,(H,27,30)/t24-,25+/m0/s1
SMILESCCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCC
MNX internals
InChI (mnx)InChI=1/C26H53NO3/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/h24-25,28-29H,3-23H2,1-2H3,(H,27,30)/t24-,25+/m0/s1 Image of MNXM147208
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][CH2:19][CH2:21][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)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:82841
chebi:82841
LGOFBZUQIUVJFS-LOSJGSFVSA-N 		N-octanoylsphinganine
Cer(d18:0/8:0)
N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]octanamide
N-capryloyldihydroceramide
N-caprylylsphinganine
N-octanoyldihydrosphingosine

SLM:000389788
slm:000389788
LGOFBZUQIUVJFS-LOSJGSFVSA-N 		N-(octanoyl)-sphinganine
Cer(d18:0/8:0)
Ceramide (d18:0/8:0)

sabiork.compound:25130
sabiorkM:25130
LGOFBZUQIUVJFS-LOSJGSFVSA-N 		N-Octanoylsphinganine