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N-acetylabyssenin-C
SpectraBase Compound ID GWBNWznRlu4
InChI InChI=1S/C26H38N4O5/c1-7-15(3)22-25(33)27-12-11-18-9-10-21(35-6)19(13-18)14-20(28-17(5)31)24(32)29-23(16(4)8-2)26(34)30-22/h9-13,15-16,20,22-23H,7-8,14H2,1-6H3,(H,27,33)(H,28,31)(H,29,32)(H,30,34)/b12-11-
InChIKey ZPCYPMSYCMXGML-QXMHVHEDSA-N
Mol Weight 486.6 g/mol
Molecular Formula C26H38N4O5
Exact Mass 486.28422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68krZ1IgenA
Name N-acetylabyssenin-C
Alternate Name(s) N-[6,9-disec-butyl-15-methoxy-5,8,11-trioxo-4,7,10-triazabicyclo[12.3.1]octadeca-1(18),2,14,16-tetraen-12-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38N4O5
InChI InChI=1S/C26H38N4O5/c1-7-15(3)22-25(33)27-12-11-18-9-10-21(35-6)19(13-18)14-20(28-17(5)31)24(32)29-23(16(4)8-2)26(34)30-22/h9-13,15-16,20,22-23H,7-8,14H2,1-6H3,(H,27,33)(H,28,31)(H,29,32)(H,30,34)/b12-11-
InChIKey ZPCYPMSYCMXGML-QXMHVHEDSA-N
Molecular Weight 486.613 g/mol
SMILES N1C(C(N\C=C/c2cc(CC(C(NC(C1=O)C(CC)C)=O)NC(=O)C)c(OC)cc2)=O)C(CC)C
SPLASH splash10-000i-2395800000-d0514a84352d4c67d71e
Source of Spectrum U-74-1920-21
Wiley ID 1396477