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N-hexacosanoylsphinganine

Properties

Image

Occurences in reactions

MNX_ID

MNXM63798

	#reac
in my sandbox	0
in MNXref (generic)	12
in models (compartimentalized)	1

formula

C₄₄H₈₉NO₃

charge

mass

679.68425

reference

chebi:52962

InChIKey

NWERZHCPHDHUMO-WZYYJWNZSA-N

InChI

InChI=1S/C44H89NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-44(48)45-42(41-46)43(47)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2/h42-43,46-47H,3-41H2,1-2H3,(H,45,48)/t42-,43+/m0/s1

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:52962 chebi:52962	N-hexacosanoylsphinganine C26DH Cer Cer(d18:0/26:0) N-(hexacosanoyl)-sphinganine N-[(2S,3R)-1,3-bis(oxidanyl)octadecan-2-yl]hexacosanamide N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]hexacosanamide ceramide-1 (sphinganine:N-C26:0)
hmdb:HMDB0011771	Cer(d18:0/26:0) C26DH Cer C26DH cer Ceramide Ceramide(D18:0/26:0) Ceramide-1 (sphinganine:n-C26:0) N-(Hexacosanoyl)-D-erythro-sphinganine N-(Hexacosanoyl)-dihydrosphingosine N-(Hexacosanoyl)-sphinganine N-[(2S,3R)-1,3-Bis(oxidanyl)octadecan-2-yl]hexacosanamide N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]hexacosanamide
lipidmaps:LMSP02020014 lipidmapsM:LMSP02020014	Cer(d18:0/26:0) C26DH Cer Cer 44:0 Cer[NdS] N-(hexacosanoyl)-dihydroceramide N-(hexacosanoyl)-sphinganine O2
seed.compound:cpd33133 seedM:cpd33133	Cer(d18:0/26:0) N-(hexacosanoyl)-sphinganine N-hexacosanoylsphinganine ceramide A (C26) ceramide-1 (C26) ceramide-1 (sphinganine:N-C26:0)
seed.compound:cpd15221 seedM:cpd15221	Ceramide-1 Sphinganine:n-C26:0) Ceramide-1 (Sphinganine:n-C26:0) cer1_26
metacyc.compound:CPD-16353 metacycM:CPD-16353	N-(hexacosanoyl)-sphinganine C26 dihydrosphingosine Cer(d18:0/26:0) N-hexacosanoylsphinganine ceramide A (C26) ceramide-1 (C26) ceramide-1 (sphinganine:N-C26:0)
SLM:000000492 slm:000000492	N-(hexacosanoyl)-sphinganine Cer(d18:0/26:0) Ceramide (d18:0/26:0)
hmdb:HMDB11771 seedM:M_cpd15221 seedM:M_cpd33133	secondary/obsolete/fantasy identifier