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(1'S,2'S,3'R,4'S)-5-[2',3',4',5'-Tetrahydroxy-1'-(1H-indol-3-yl)-(2,3:4,5)-di-o-isopropylidene-pentan-1'-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1'S,2'S,3'R,4'S)-5-[2',3',4',5'-Tetrahydroxy-1'-(1H-indol-3-yl)-(2,3:4,5)-di-o-isopropylidene-pentan-1'-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione
SpectraBase Compound ID AWtrDUN6mVF
InChI InChI=1S/C25H31NO8/c1-23(2)29-12-16(30-23)19-20(32-24(3,4)31-19)17(14-11-26-15-10-8-7-9-13(14)15)18-21(27)33-25(5,6)34-22(18)28/h7-11,16-20,26H,12H2,1-6H3/t16-,17+,19-,20-/m0/s1
InChIKey UUAUENHWLGATMX-HNJRGHQBSA-N
Mol Weight 473.52 g/mol
Molecular Formula C25H31NO8
Exact Mass 473.204967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UL8bwbagSf
Name (1'S,2'S,3'R,4'S)-5-[2',3',4',5'-Tetrahydroxy-1'-(1H-indol-3-yl)-(2,3:4,5)-di-o-isopropylidene-pentan-1'-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.204966954 u
Formula C25H31NO8
InChI InChI=1S/C25H31NO8/c1-23(2)29-12-16(30-23)19-20(32-24(3,4)31-19)17(14-11-26-15-10-8-7-9-13(14)15)18-21(27)33-25(5,6)34-22(18)28/h7-11,16-20,26H,12H2,1-6H3/t16-,17+,19-,20-/m0/s1
InChIKey UUAUENHWLGATMX-HNJRGHQBSA-N
Molecular Weight 473.522 g/mol
SMILES C1([C@](C2C(OC(C)(C)OC2=O)=O)([C@]2([C@]([C@]3(OC(C)(C)OC3)[H])(OC(O2)(C)C)[H])[H])[H])=CNC2=C1C=CC=C2