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N-(tetracosanoyl)-1-O-beta-D-glucosyl-tetradecasphing-4-enine

PropertiesImage
MNX_IDMNXM156321 Image of MNXM156321
referenceslm:000399541
formulaC44H85NO8
global charge0
mol weight756.163
InChIKeyHJMNKCWRXPNYBS-IYFIADHGSA-N
InChIInChI=1S/C44H85NO8/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-40(48)45-37(38(47)33-31-29-27-25-12-10-8-6-4-2)36-52-44-43(51)42(50)41(49)39(35-46)53-44/h31,33,37-39,41-44,46-47,49-51H,3-30,32,34-36H2,1-2H3,(H,45,48)/b33-31+/t37-,38+,39+,41+,42-,43+,44+/m0/s1
SMILESCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C44H85NO8/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-40(48)45-37(38(47)33-31-29-27-25-12-10-8-6-4-2)36-52-44-43(51)42(50)41(49)39(35-46)53-44/h31,33,37-39,41-44,46-47,49-51H,3-30,32,34-36H2,1-2H3,(H,45,48)/b33-31+/t37-,38+,39+,41+,42-,43+,44+/m0/s1 Image of MNXM156321
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][C:40](=[N:45][C@@H:37]([CH2:36][O:52][C@H:44]1[C@H:43]([OH:51])[C@@H:42]([OH:50])[C@H:41]([OH:49])[C@@H:39]([CH2:35][OH:46])[O:53]1)[C@@H:38](/[CH:33]=[CH:31]/[CH2:29][CH2:27][CH2:25][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:47])[OH:48]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000399541
slm:000399541
HJMNKCWRXPNYBS-IYFIADHGSA-N 		N-(tetracosanoyl)-1-O-beta-D-glucosyl-tetradecasphing-4-enine
GlcCer(d14:1(4E)/24:0)
Glucosyl ceramide (d14:1(4E)/24:0)

lipidmaps:LMSP0501AA44
lipidmapsM:LMSP0501AA44
HJMNKCWRXPNYBS-IYFIADHGSA-N 		GlcCer(d14:1/24:0)
GlcCer(d14:1(4E)/24:0)
HexCer 38:1
N-(tetracosanoyl)-1-beta-glucosyl-tetradecasphing-4-enine
O2

CHEBI:177007
chebi:177007
HJMNKCWRXPNYBS-QIKWIXAXSA-N 		GlcCer(d14:1/24:0)
N-[(E,2S,3R)-3-hydroxy-1-[(2R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytetradec-4-en-2-yl]tetracosanamide