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ASTERIACERAMIDE_A;(2-S,3-S,4-R,13-Z)-2-[(2'-R)-2-HYDROXYHEXADECANOYLAMINO]-13-DOCOSENE-1,3,4-TRIOL
SpectraBase Compound ID Iv1jQmD27gp
InChI InChI=1S/C38H75NO5/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-35(41)37(43)34(33-40)39-38(44)36(42)32-30-28-26-24-21-16-14-12-10-8-6-4-2/h17-18,34-37,40-43H,3-16,19-33H2,1-2H3,(H,39,44)/b18-17-/t34-,35-,36+,37+/m0/s1
InChIKey NMJATLITVAZZIR-FBJMOGHKSA-N
Mol Weight 626.0 g/mol
Molecular Formula C38H75NO5
Exact Mass 625.564525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hf9V0ZJyLcW
Name ASTERIACERAMIDE_A;(2-S,3-S,4-R,13-Z)-2-[(2'-R)-2-HYDROXYHEXADECANOYLAMINO]-13-DOCOSENE-1,3,4-TRIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H75NO5
InChI InChI=1S/C38H75NO5/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-35(41)37(43)34(33-40)39-38(44)36(42)32-30-28-26-24-21-16-14-12-10-8-6-4-2/h17-18,34-37,40-43H,3-16,19-33H2,1-2H3,(H,39,44)/b18-17-/t34-,35-,36+,37+/m0/s1
InChIKey NMJATLITVAZZIR-FBJMOGHKSA-N
Literature Reference Author T.ISHII,T.OKINO,Y.MINO
Literature Reference Citation J.NAT.PROD.,69,1080(2006)
Literature Reference DOI 10.1021/np050530e
Molecular Weight 626.017 g/mol
Solvent C5D5N
Source File Reference UWMZ19005