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#3B;(1-R)-(1,3,5/2,4)-3-O-(BETA-D-GLUCOPYRANOSYL)-2,4-DIHYDROXY-5-HYDROXYMETHYL-N-[(1-S)-(1,4,6/5)-3-HYDROXYMETHYL-4,5,6-TRIHYDROXYCYCLOHEX-2-ENYL]-CYCLOHEXYLA

View entire compound with spectra: 1 NMR

#3B;(1-R)-(1,3,5/2,4)-3-O-(BETA-D-GLUCOPYRANOSYL)-2,4-DIHYDROXY-5-HYDROXYMETHYL-N-[(1-S)-(1,4,6/5)-3-HYDROXYMETHYL-4,5,6-TRIHYDROXYCYCLOHEX-2-ENYL]-CYCLOHEXYLA
SpectraBase Compound ID 6YVJh4go2uE
InChI InChI=1S/C20H35NO13/c22-3-6-1-8(13(27)16(30)11(6)25)21-9-2-7(4-23)12(26)19(14(9)28)34-20-18(32)17(31)15(29)10(5-24)33-20/h1,7-32H,2-5H2/t7-,8-,9-,10-,11+,12-,13-,14+,15-,16-,17+,18-,19+,20+/m0/s1
InChIKey IKRNIUUCBHMQNH-LZFLADEISA-N
Mol Weight 497.5 g/mol
Molecular Formula C20H35NO13
Exact Mass 497.21084 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3eVM8N2QAIa
Name #3B;(1-R)-(1,3,5/2,4)-3-O-(BETA-D-GLUCOPYRANOSYL)-2,4-DIHYDROXY-5-HYDROXYMETHYL-N-[(1-S)-(1,4,6/5)-3-HYDROXYMETHYL-4,5,6-TRIHYDROXYCYCLOHEX-2-ENYL]-CYCLOHEXYLA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H35NO13
InChI InChI=1S/C20H35NO13/c22-3-6-1-8(13(27)16(30)11(6)25)21-9-2-7(4-23)12(26)19(14(9)28)34-20-18(32)17(31)15(29)10(5-24)33-20/h1,7-32H,2-5H2/t7-,8-,9-,10-,11+,12-,13-,14+,15-,16-,17+,18-,19+,20+/m0/s1
InChIKey IKRNIUUCBHMQNH-LZFLADEISA-N
Literature Reference Author N.ASANO,Y.KAMEDA,K.MATSUI
Literature Reference Citation J.ANTIBIOTICS,44,1406(1991)
Literature Reference DOI 10.7164/antibiotics.44.1406
Molecular Weight 497.497 g/mol
Sample ID 46015
Solvent D2O