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N-Palmityl-D-(erythro)-octadecasphinga-4(E),8(E)-dienine

View entire compound with spectra: 2 MS (GC)

N-Palmityl-D-(erythro)-octadecasphinga-4(E),8(E)-dienine
SpectraBase Compound ID 3GWEGHXDGqr
InChI InChI=1S/C34H65NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,27,29,32-33,36-37H,3-18,20,22-26,28,30-31H2,1-2H3,(H,35,38)/b21-19+,29-27+
InChIKey GMWIWVUTMCBDSP-ZNPGVSGMSA-N
Mol Weight 535.9 g/mol
Molecular Formula C34H65NO3
Exact Mass 535.496445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtNCKpAVc2m
Name N-Palmityl-D-(erythro)-octadecasphinga-4(E),8(E)-dienine
Alternate Name(s) Spingosine N-[(4E,8E)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]hexadecanamide N-[(3E,7E)-2-hydroxy-1-(hydroxymethyl)heptadeca-3,7-dienyl]hexadecanamide N-[(4E,8E)-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]hexadecanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H65NO3
InChI InChI=1S/C34H65NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,27,29,32-33,36-37H,3-18,20,22-26,28,30-31H2,1-2H3,(H,35,38)/b21-19+,29-27+
InChIKey GMWIWVUTMCBDSP-ZNPGVSGMSA-N
Molecular Weight 535.898 g/mol
SMILES N(C(CO)C(\C=C\CC\C=C\CCCCCCCCC)O)C(=O)CCCCCCCCCCCCCCC
SPLASH splash10-0f89-0090010000-f47e26848fb8a734d5bf
Source of Spectrum Y1-35-579-1
Wiley ID 1526696