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PORTULACERAMIDE-A;(2S,3S,4R,8E)-2-[(2'R)-2-HYDROXYLPENTADECANOYLAMINO]-8-DODECENE-1,3,4-TRIOL
SpectraBase Compound ID B8nxoFeicol
InChI InChI=1S/C27H53NO5/c1-3-5-7-9-11-12-13-14-15-17-19-21-25(31)27(33)28-23(22-29)26(32)24(30)20-18-16-10-8-6-4-2/h8,10,23-26,29-32H,3-7,9,11-22H2,1-2H3,(H,28,33)/b10-8+/t23-,24+,25+,26-/m0/s1
InChIKey ATXQAVMKENAWNG-XYJAQCIBSA-N
Mol Weight 471.7 g/mol
Molecular Formula C27H53NO5
Exact Mass 471.392374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ddf91dhA6M6
Name PORTULACERAMIDE-A;(2S,3S,4R,8E)-2-[(2'R)-2-HYDROXYLPENTADECANOYLAMINO]-8-DODECENE-1,3,4-TRIOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H53NO5
InChI InChI=1S/C27H53NO5/c1-3-5-7-9-11-12-13-14-15-17-19-21-25(31)27(33)28-23(22-29)26(32)24(30)20-18-16-10-8-6-4-2/h8,10,23-26,29-32H,3-7,9,11-22H2,1-2H3,(H,28,33)/b10-8+/t23-,24+,25+,26-/m0/s1
InChIKey ATXQAVMKENAWNG-XYJAQCIBSA-N
Literature Reference Author X.LEI,J.LI,B.LIU,N.ZHANG,H.LIU
Literature Reference Citation MOLECULES,20,16375(2015)
Literature Reference DOI 10.3390/molecules200916375
Molecular Weight 471.722 g/mol
Solvent C5D5N
Source File Reference UWPA5140