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1-(2,3,4-tri-o-Acetyl.beta.D-ribopyranosyl)indol-3-carbaldehyde
SpectraBase Compound ID 81gS87DX6rs
InChI InChI=1S/C20H21NO8/c1-11(23)27-17-10-26-20(19(29-13(3)25)18(17)28-12(2)24)21-8-14(9-22)15-6-4-5-7-16(15)21/h4-9,17-20H,10H2,1-3H3/t17-,18-,19-,20-/m1/s1
InChIKey XHLSTWDJFRXMTM-UAFMIMERSA-N
Mol Weight 403.39 g/mol
Molecular Formula C20H21NO8
Exact Mass 403.126717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8OBL9b5Jh2k
Name 1-(2,3,4-tri-o-Acetyl.beta.D-ribopyranosyl)indol-3-carbaldehyde
Comments Computed using HOSE algorithm
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Exact Mass 403.126716632 u
Formula C20H21NO8
InChI InChI=1S/C20H21NO8/c1-11(23)27-17-10-26-20(19(29-13(3)25)18(17)28-12(2)24)21-8-14(9-22)15-6-4-5-7-16(15)21/h4-9,17-20H,10H2,1-3H3/t17-,18-,19-,20-/m1/s1
InChIKey XHLSTWDJFRXMTM-UAFMIMERSA-N
Molecular Weight 403.387 g/mol
SMILES [C@]1([C@@]([C@](OC(C)=O)([C@@](CO1)(OC(C)=O)[H])[H])(OC(=O)C)[H])(N1C=C(C=O)C=2C1=CC=CC2)[H]