Search MNXref
 Feedback

N-(2-hydroxyhexacosanoyl)-4-hydroxysphinganine

MNXM498374 is deprecated and here replaced by MNXM1368537
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368537 Image of MNXM1368537
referencechebi:64958
formulaC44H89NO5
global charge0
mol weight712.198
InChIKeyXNLFLZXNXQVPII-SCFNZONMSA-N
InChIInChI=1S/C44H89NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-42(48)44(50)45-40(39-46)43(49)41(47)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h40-43,46-49H,3-39H2,1-2H3,(H,45,50)/t40-,41?,42?,43-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO)[C@H](O)C(O)CCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C44H89NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-42(48)44(50)45-40(39-46)43(49)41(47)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h40-43,46-49H,3-39H2,1-2H3,(H,45,50)/t40-,41?,42?,43-/m0/s1 Image of MNXM1368537
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH:42]([C:44](=[N:45][C@@H:40]([CH2:39][OH:46])[C@@H:43]([CH:41]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:47])[OH:49])[OH:50])[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

CHEBI:64958
chebi:64958
XNLFLZXNXQVPII-SCFNZONMSA-N 		N-(2-hydroxyhexacosanoyl)-4-hydroxysphinganine
Cer(t18:0/26:0(2-OH))
N-(2-hydroxyhexacosanoyl)phytoceramide
N-(2-hydroxyhexacosanoyl)phytosphingosine
PHS-C26

seed.compound:cpd25295
seedM:cpd25295
XNLFLZXNXQVPII-UHFFFAOYSA-N 		N-(2-hydroxyhexacosanoyl)-4-hydroxysphinganine
N-(2-hydroxyhexacosanoyl)-phytosphingosine
Phytosphingosine-2-hydroxy-26:0, ceramide
hmdb:HMDB0035472
XNLFLZXNXQVPII-UHFFFAOYSA-N 		N-(2R-Hydroxyhexacosanoyl)-2S-amino-1,3S,4R-octadecanetriol
2-Hydroxy-N-(1,3,4-trihydroxyoctadecan-2-yl)hexacosanimidate
2-hydroxy-N-(1,3,4-trihydroxyoctadecan-2-yl)hexacosanamide

CHEBI:172804
chebi:172804
XNLFLZXNXQVPII-UHFFFAOYSA-N 		N-(2R-Hydroxyhexacosanoyl)-2S-amino-1,3S,4R-octadecanetriol
2-hydroxy-N-(1,3,4-trihydroxyoctadecan-2-yl)hexacosanamide

hmdb:HMDB35472
seedM:M_cpd25295 		secondary/obsolete/fantasy identifier