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Symbiramide
SpectraBase Compound ID CK2AHenNqxm
InChI InChI=1S/C36H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(40)36(41)37-33(32-38)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29,31,33-35,38-40H,3-28,30,32H2,1-2H3,(H,37,41)/b31-29+/t33?,34-,35-/m1/s1
InChIKey LJKCPJOLKILGIR-NGJCEQQKSA-N
Mol Weight 582.0 g/mol
Molecular Formula C36H71NO4
Exact Mass 581.53831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QPtgDAHv9
Name Symbiramide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H71NO4
InChI InChI=1S/C36H71NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(40)36(41)37-33(32-38)34(39)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29,31,33-35,38-40H,3-28,30,32H2,1-2H3,(H,37,41)/b31-29+/t33?,34-,35-/m1/s1
InChIKey LJKCPJOLKILGIR-NGJCEQQKSA-N
Molecular Weight 581.967 g/mol
SMILES N(C([C@@](\C=C\CCCCCCCCCCCCCC)(O)[H])=O)C(CO)[C@](O)(CCCCCCCCCCCCCCC)[H]
SPLASH splash10-0006-9083020000-32a5424f7aa1a002ff8f
Source of Spectrum KC-1992-349-1
Synonyms (2R,3E)-2-hydroxy-N-[(2R)-2-hydroxy-1-(hydroxymethyl)heptadecyl]-3-octadecenamide
Wiley ID 775904