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N-(2-amino-2-keto-ethyl)-[(5-hydroxy-2-keto-3-methylol-1-cyclopent-3-enyl)oxy]-N-[hydroxy-(methyl-(12-methyltridecyl)amino)oxy-phosphoryl]phosphonamidic acid
SpectraBase Compound ID 8yLUDfmKjHs
InChI InChI=1S/C23H45N3O10P2/c1-18(2)13-11-9-7-5-4-6-8-10-12-14-25(3)36-38(33,34)26(16-21(24)29)37(31,32)35-23-20(28)15-19(17-27)22(23)30/h15,18,20,23,27-28H,4-14,16-17H2,1-3H3,(H2,24,29)(H,31,32)(H,33,34)
InChIKey OTFVDBQQAXNSFG-UHFFFAOYSA-N
Mol Weight 585.6 g/mol
Molecular Formula C23H45N3O10P2
Exact Mass 585.258019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CTAuuMcOk7q
Name N-(2-amino-2-keto-ethyl)-[(5-hydroxy-2-keto-3-methylol-1-cyclopent-3-enyl)oxy]-N-[hydroxy-(methyl-(12-methyltridecyl)amino)oxy-phosphoryl]phosphonamidic acid
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H43N3O10P2
InChI InChI=1S/C23H45N3O10P2/c1-18(2)13-11-9-7-5-4-6-8-10-12-14-25(3)36-38(33,34)26(16-21(24)29)37(31,32)35-23-20(28)15-19(17-27)22(23)30/h15,18,20,23,27-28H,4-14,16-17H2,1-3H3,(H2,24,29)(H,31,32)(H,33,34)
InChIKey OTFVDBQQAXNSFG-UHFFFAOYSA-N
Literature Reference Author H.TAKEUCHI,N.ASAI,K.TANABE,T.KOZAKI,M.FUJITA,T.SAKAI,A.OKUDA ,N.NARUSE,S.YAMAMOTO
Literature Reference Citation J.ANTIBIOTICS,52,971(1999)
Literature Reference DOI 10.7164/antibiotics.52.971
Molecular Weight 583.556 g/mol
Solvent CD3OD
Source File Reference UWRU1071