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N6-BENZOYL-9-(5-O-PIVALOYL-2,3-DIDEOXY-2-PHENYLTHIO-BETA-D-ERYTHRO-PENTOFURANOSYL)-ADENINE
SpectraBase Compound ID 6LDkFzIrjjq
InChI InChI=1S/C28H29N5O4S/c1-28(2,3)27(35)36-15-19-14-21(38-20-12-8-5-9-13-20)26(37-19)33-17-31-22-23(29-16-30-24(22)33)32-25(34)18-10-6-4-7-11-18/h4-13,16-17,19,21,26H,14-15H2,1-3H3,(H,29,30,32,34)/t19-,21+,26+/m1/s1
InChIKey YOTRPXFYWAUKBN-DYRZZGSRSA-N
Mol Weight 531.63 g/mol
Molecular Formula C28H29N5O4S
Exact Mass 531.194026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZnbEXIi6aX
Name N6-BENZOYL-9-(5-O-PIVALOYL-2,3-DIDEOXY-2-PHENYLTHIO-BETA-D-ERYTHRO-PENTOFURANOSYL)-ADENINE
Compound Number 23-BE TA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29N5O4S
InChI InChI=1S/C28H29N5O4S/c1-28(2,3)27(35)36-15-19-14-21(38-20-12-8-5-9-13-20)26(37-19)33-17-31-22-23(29-16-30-24(22)33)32-25(34)18-10-6-4-7-11-18/h4-13,16-17,19,21,26H,14-15H2,1-3H3,(H,29,30,32,34)/t19-,21+,26+/m1/s1
InChIKey YOTRPXFYWAUKBN-DYRZZGSRSA-N
Literature Reference Author H.KAWAKAMI,T.EBATA,K.KOSEKI,K.OKANO,K.MATSUMOTO,H.MATSUSHITA
Literature Reference Citation HETEROCYCLES,36,2765(1993)
Literature Reference DOI 10.3987/COM-93-6503
Molecular Weight 531.629 g/mol
Solvent CDCl3
Source File Reference UWCP1293